0 B16R2.2256 C(#Cc1ccccc1)Nc2ccccc2 Amb24081250 [0,0,0,0,0,0|2,0,1]=3 1 B16R2.2256 C(=N/c1ccccc1)/Nc2ccccc2 Amb22350571 [0,0,0,0,0,0|3,0,0]=3 2 B16R2.2256 C(=N\Cc1ccccc1)/c2ccccc2 Amb33513282 [0,0,0,0,0,0|1,0,1]=2 3 B16R2.2256 C(=N\Nc1ccccc1)/c2ccccc2 Amb5720542 [0,0,0,0,0,0|2,0,1]=3 4 B16R2.2256 C(=N\c1ccccc1)/Nc2ccccc2 Amb6298318 [0,0,0,0,0,0|3,0,0]=3 5 B16R2.2256 C1=C(COCc2ccccc2)CCNC1 Amb27767132 [0,0,0,0,0,0|1,0,3]=4 6 B16R2.2256 C1=COC(COCc2ccccc2)CC1 Amb27612986 [0,0,0,0,0,0|1,0,3]=4 7 B16R2.2256 c1cc(CCCc2ccncc2)ccn1 Amb6357749 [0,0,0,0,0,0|3,0,0]=3 8 B16R2.2256 c1cc(CNCc2ccncc2)ccn1 Amb6729586 [0,0,0,0,0,0|3,0,0]=3 9 B16R2.2256 c1cc(CNCc2ccncc2)ccn1 Amb6864949 [0,0,0,0,0,0|3,0,0]=3 10 B16R2.2256 c1cc(CNCc2cnccn2)ccn1 Amb18314232 [0,0,0,0,0,0|4,0,0]=4 11 B16R2.2256 c1ccc(CCCc2ccccc2)cc1 Amb2721029 [0,0,0,0,0,0|1,0,0]=1 12 B16R2.2256 c1ccc(CCCc2ccccn2)cc1 Amb5718975 [0,0,0,0,0,0|2,0,0]=2 13 B16R2.2256 c1ccc(CCNc2ccccc2)cc1 Amb2693183 [0,0,0,0,0,0|2,0,0]=2 14 B16R2.2256 c1ccc(CCOc2ccccc2)cc1 Amb2720867 [0,0,0,0,0,0|2,0,0]=2 15 B16R2.2256 c1ccc(CNCc2ccccc2)cc1 Amb17743700 [0,0,0,0,0,0|1,0,0]=1 16 B16R2.2256 c1ccc(CNCc2ccccn2)cc1 Amb6356033 [0,0,0,0,0,0|2,0,0]=2 17 B16R2.2256 c1ccc(CNCc2ccccn2)nc1 Amb33622775 [0,0,0,0,0,0|3,0,0]=3 18 B16R2.2256 c1ccc(CNCc2ccccn2)nc1 Amb3939204 [0,0,0,0,0,0|3,0,0]=3 19 B16R2.2256 c1ccc(CNCc2cccnc2)cc1 Amb6356030 [0,0,0,0,0,0|2,0,0]=2 20 B16R2.2256 c1ccc(CNCc2cccnc2)nc1 Amb6699051 [0,0,0,0,0,0|3,0,0]=3 21 B16R2.2256 c1ccc(CNCc2ccncc2)cc1 Amb6356034 [0,0,0,0,0,0|2,0,0]=2 22 B16R2.2256 c1ccc(CNCc2ccncc2)nc1 Amb6699053 [0,0,0,0,0,0|3,0,0]=3 23 B16R2.2256 c1ccc(CNCc2ccncn2)cc1 Amb19030316 [0,0,0,0,0,0|3,0,0]=3 24 B16R2.2256 c1ccc(CNCc2cnccn2)nc1 Amb18314224 [0,0,0,0,0,0|4,0,0]=4 25 B16R2.2256 c1ccc(CNCc2cncnc2)cc1 Amb18314258 [0,0,0,0,0,0|3,0,0]=3 26 B16R2.2256 c1ccc(CNCc2cncnc2)cc1 Amb33457833 [0,0,0,0,0,0|3,0,0]=3 27 B16R2.2256 c1ccc(NCCc2ccccn2)cc1 Amb4020684 [0,0,0,0,0,0|3,0,0]=3 28 B16R2.2256 c1ccc(SCCc2ccncc2)cc1 Amb583020 [0,0,0,0,0,0|3,0,0]=3 29 B16R2.2256 c1ccc(SCSc2ccccc2)cc1 Amb2684782 [0,0,0,0,0,0|3,0,0]=3 30 B16R2.2256 c1ccc(\N=N\Nc2ccccc2)cc1 Amb7809237 [0,0,0,0,0,0|3,0,0]=3 31 B16R2.2256 c1cncc(CNCc2cccnc2)c1 Amb6316094 [0,0,0,0,0,0|3,0,0]=3 32 B16R2.2256 c1cncc(CNCc2ccncc2)c1 Amb6332138 [0,0,0,0,0,0|3,0,0]=3 33 B16R2.2256 c1cncc(CNCc2cnccn2)c1 Amb18314228 [0,0,0,0,0,0|4,0,0]=4 34 B17R2.143 BrC(Cc1ccccc1)Cc2ccccc2 Amb17755302 [0,1,0,0,0,0|1,0,0]=2 35 B17R2.143 CN(Cc1ccccc1)Cc2ccccc2 Amb1925683 [0,1,0,0,0,0|1,0,0]=2 36 B17R2.143 C\C(=N/c1ccccc1)Nc2ccccc2 Amb8505021 [0,1,0,0,0,0|3,0,0]=4 37 B17R2.143 ClP(Oc1ccccc1)Oc2ccccc2 Amb23496207 [0,1,0,0,0,0|3,0,0]=4 38 B17R2.143 N=C(Nc1ccccc1)Nc2ccccc2 Amb1299410 [0,1,0,0,0,0|3,0,0]=4 39 B17R2.143 N=C(Nc1ccccc1)Nc2ccccc2 Amb22002351 [0,1,0,0,0,0|3,0,0]=4 40 B17R2.143 NC(Cc1ccccc1)Cc2ccccc2 Amb1114019 [0,1,0,0,0,0|1,0,0]=2 41 B17R2.143 NC(Cc1ccccc1)Cc2ccccc2 Amb2816835 [0,1,0,0,0,0|1,0,0]=2 42 B17R2.143 NC(Cc1ccccc1)Cc2cccnc2 Amb19024201 [0,1,0,0,0,0|2,0,0]=3 43 B17R2.143 NN(Cc1ccccc1)Cc2ccccc2 Amb6608929 [0,1,0,0,0,0|1,0,0]=2 44 B17R2.143 N\C(=N\c1ccccc1)Nc2ccccc2 Amb22330448 [0,1,0,0,0,0|3,0,0]=4 45 B17R2.143 O=C(Cc1ccccc1)Cc2ccccc2 Amb6354516 [0,1,0,0,0,0|1,0,0]=2 46 B17R2.143 O=C(Cc1ccccc1)Cc2cccnc2 Amb32684178 [0,1,0,0,0,0|2,0,0]=3 47 B17R2.143 O=C(Cc1ccccc1)Nc2ccccc2 Amb3099547 [0,1,0,0,0,0|2,0,0]=3 48 B17R2.143 O=C(Cc1ccccc1)Nc2ccccn2 Amb6560630 [0,1,0,0,0,0|3,0,0]=4 49 B17R2.143 O=C(Nc1ccccc1)Nc2ccccc2 Amb1245995 [0,1,0,0,0,0|3,0,0]=4 50 B17R2.143 O=C(Oc1ccccc1)Oc2ccccc2 Amb1260798 [0,1,0,0,0,0|3,0,0]=4 51 B17R2.143 O=S(Cc1ccccc1)Cc2ccccc2 Amb8387527 [0,1,0,0,0,0|0,1,0]=2 52 B17R2.143 O=[PH](Oc1ccccc1)Oc2ccccc2 Amb8513156 [0,1,0,0,0,0|3,0,0]=4 53 B17R2.143 OC(Cc1ccccc1)Cc2ccccc2 Amb1110031 [0,1,0,0,0,0|1,0,0]=2 54 B17R2.143 ON(Cc1ccccc1)Cc2ccccc2 Amb2226907 [0,1,0,0,0,0|1,0,0]=2 55 B17R2.143 S=C(Nc1ccccc1)Nc2ccccc2 Amb534979 [0,1,0,0,0,0|3,0,0]=4 56 B17R2.143 S=C(Oc1ccccc1)Oc2ccccc2 Amb2614902 [0,1,0,0,0,0|3,0,0]=4 57 B17R2.143 S=C(Sc1ccccc1)Sc2ccccc2 Amb2609041 [0,1,0,0,0,0|3,0,0]=4 58 B17R2.143 SC(Cc1ccccc1)Cc2ccccc2 Amb7784708 [0,1,0,0,0,0|1,0,0]=2 59 B17R2.143 S\C(=N\c1ccccc1)Nc2ccccc2 Amb3467091 [0,1,0,0,0,0|3,0,0]=4 60 B17R2.143 [O-]\C(=N/c1ccccc1)Nc2ccccc2 Amb8488212 [0,1,0,0,0,0|3,0,0]=4 61 B17R2.143 [O-]\[N+](=C/c1ccccn1)Cc2ccccc2 Amb17844279 [0,1,0,0,0,0|2,0,1]=4 62 B17R2.143 [O-]\[N+](=C/c1ccccn1)Cc2ccccc2 Amb17844280 [0,1,0,0,0,0|2,0,1]=4 63 B17R2.143 [Se]=C(Nc1ccccc1)Nc2ccccc2 Amb2704342 [0,1,0,0,0,0|3,0,0]=4 64 B17R2.216 Brc1ccc(CNCc2ccccc2)cc1 Amb22587996 [0,1,0,0,0,0|1,0,0]=2 65 B17R2.216 Brc1ccc(CNCc2ccccc2)cc1 Amb838866 [0,1,0,0,0,0|1,0,0]=2 66 B17R2.216 Brc1ccc(CNCc2ccccc2)nc1 Amb27223602 [0,1,0,0,0,0|2,0,0]=3 67 B17R2.216 Brc1ccc(CNCc2ccccn2)cc1 Amb10610049 [0,1,0,0,0,0|2,0,0]=3 68 B17R2.216 Brc1ccc(CNCc2ccccn2)cc1 Amb6699016 [0,1,0,0,0,0|2,0,0]=3 69 B17R2.216 Brc1ccc(CNCc2cccnc2)cc1 Amb6352451 [0,1,0,0,0,0|2,0,0]=3 70 B17R2.216 Brc1ccc(CNCc2ccncc2)cc1 Amb6729560 [0,1,0,0,0,0|2,0,0]=3 71 B17R2.216 Brc1ccc(COCc2ccccc2)cc1 Amb19301961 [0,1,0,0,0,0|0,0,0]=1 72 B17R2.216 Brc1ccc(NCCc2ccccc2)cc1 Amb6696485 [0,1,0,0,0,0|2,0,0]=3 73 B17R2.216 Brc1ccc(NCCc2ccccc2)nc1 Amb6623061 [0,1,0,0,0,0|3,0,0]=4 74 B17R2.216 Brc1ccc(OCCc2ccccc2)cc1 Amb6649169 [0,1,0,0,0,0|2,0,0]=3 75 B17R2.216 Brc1ccc(OCCc2ccncc2)cc1 Amb32413774 [0,1,0,0,0,0|3,0,0]=4 76 B17R2.216 Brc1cnc(CNCc2ccccc2)nc1 Amb24078771 [0,1,0,0,0,0|3,0,0]=4 77 B17R2.216 Cc1ccc(CCNc2ccccc2)cn1 Amb6344803 [0,1,0,0,0,0|3,0,0]=4 78 B17R2.216 Cc1ccc(CNCc2ccccc2)cc1 Amb6687346 [0,1,0,0,0,0|1,0,0]=2 79 B17R2.216 Cc1ccc(CNCc2ccccn2)cc1 Amb6355683 [0,1,0,0,0,0|2,0,0]=3 80 B17R2.216 Cc1ccc(CNCc2cccnc2)cc1 Amb6355739 [0,1,0,0,0,0|2,0,0]=3 81 B17R2.216 Cc1ccc(CNCc2ccncc2)cc1 Amb6352450 [0,1,0,0,0,0|2,0,0]=3 82 B17R2.216 Cc1ccc(NCCc2ccccc2)cc1 Amb4358611 [0,1,0,0,0,0|2,0,0]=3 83 B17R2.216 Clc1ccc(CNCc2ccccc2)cc1 Amb6364679 [0,1,0,0,0,0|1,0,0]=2 84 B17R2.216 Clc1ccc(CNCc2ccccc2)nc1 Amb28342095 [0,1,0,0,0,0|2,0,0]=3 85 B17R2.216 Clc1ccc(CNCc2ccccn2)cc1 Amb6699017 [0,1,0,0,0,0|2,0,0]=3 86 B17R2.216 Clc1ccc(CNCc2cccnc2)cc1 Amb6336244 [0,1,0,0,0,0|2,0,0]=3 87 B17R2.216 Clc1ccc(CNCc2ccncc2)cc1 Amb1923364 [0,1,0,0,0,0|2,0,0]=3 88 B17R2.216 Clc1ccc(CSCc2ccccc2)cn1 Amb6675876 [0,1,0,0,0,0|1,1,0]=3 89 B17R2.216 Clc1ccc(CSCc2ccccn2)cn1 Amb21984720 [0,1,0,0,0,0|2,1,0]=4 90 B17R2.216 Clc1ccc(NCCc2ccccc2)cc1 Amb6624606 [0,1,0,0,0,0|2,0,0]=3 91 B17R2.216 Clc1ccc(\C=N\Nc2ccccc2)cc1 Amb2703784 [0,1,0,0,0,0|2,0,1]=4 92 B17R2.216 Fc1ccc(CNCc2ccccc2)cc1 Amb6352461 [0,1,0,0,0,0|1,0,0]=2 93 B17R2.216 Fc1ccc(CNCc2ccccc2)cc1 Amb8468188 [0,1,0,0,0,0|1,0,0]=2 94 B17R2.216 Fc1ccc(CNCc2ccccn2)cc1 Amb6699019 [0,1,0,0,0,0|2,0,0]=3 95 B17R2.216 Fc1ccc(CNCc2cccnc2)cc1 Amb6355690 [0,1,0,0,0,0|2,0,0]=3 96 B17R2.216 Fc1ccc(CNCc2ccncc2)cc1 Amb6332080 [0,1,0,0,0,0|2,0,0]=3 97 B17R2.216 Fc1ccc(NCCc2ccccc2)cc1 Amb6696718 [0,1,0,0,0,0|2,0,0]=3 98 B17R2.216 Ic1ccc(CNCc2ccccc2)cc1 Amb27644269 [0,1,0,0,0,0|1,0,0]=2 99 B17R2.216 Ic1ccc(COCc2ccccc2)cc1 Amb28381491 [0,1,0,0,0,0|0,0,0]=1 100 B17R2.216 Ic1ccc(OCCc2ccccc2)cc1 Amb20669160 [0,1,0,0,0,0|2,0,0]=3 101 B17R2.216 Nc1ccc(CCCc2ccccc2)cc1 Amb13952637 [0,1,0,0,0,0|1,0,0]=2 102 B17R2.216 Nc1ccc(CCCc2ncccn2)cc1 Amb18866475 [0,1,0,0,0,0|3,0,0]=4 103 B17R2.216 Nc1ccc(CCOc2ccccc2)cc1 Amb9380875 [0,1,0,0,0,0|2,0,0]=3 104 B17R2.216 Nc1ccc(COCc2ccccc2)cc1 Amb1138750 [0,1,0,0,0,0|0,0,0]=1 105 B17R2.216 Nc1ccc(NCCc2ccccc2)cc1 Amb1103721 [0,1,0,0,0,0|2,0,0]=3 106 B17R2.216 Nc1ccc(NCCc2ccccc2)cn1 Amb7767921 [0,1,0,0,0,0|3,0,0]=4 107 B17R2.216 Nc1ccc(NCCc2ccccc2)nc1 Amb5786808 [0,1,0,0,0,0|3,0,0]=4 108 B17R2.216 Nc1ccc(NCCc2ccncc2)cc1 Amb18308616 [0,1,0,0,0,0|3,0,0]=4 109 B17R2.216 Nc1ccc(OCCc2ccccc2)cc1 Amb1112778 [0,1,0,0,0,0|2,0,0]=3 110 B17R2.216 Nc1ccc(OCCc2ccccc2)nc1 Amb7790211 [0,1,0,0,0,0|3,0,0]=4 111 B17R2.216 Nc1ccc(OCCc2ccccn2)cc1 Amb1995311 [0,1,0,0,0,0|3,0,0]=4 112 B17R2.216 Nc1ccc(OCCc2ccccn2)cc1 Amb22280487 [0,1,0,0,0,0|3,0,0]=4 113 B17R2.216 Nc1ccc(OCCc2ccccn2)cc1 Amb6890877 [0,1,0,0,0,0|3,0,0]=4 114 B17R2.216 Nc1ccc(OCCc2cccnc2)cc1 Amb17241674 [0,1,0,0,0,0|3,0,0]=4 115 B17R2.216 Nc1ccc(OCCc2ccncc2)cc1 Amb18303893 [0,1,0,0,0,0|3,0,0]=4 116 B17R2.216 Nc1ccc(SCCc2ccccn2)cc1 Amb8606761 [0,1,0,0,0,0|3,0,0]=4 117 B17R2.216 Nc1cnc(COCc2ccccc2)cn1 Amb27619126 [0,1,0,0,0,0|2,0,0]=3 118 B17R2.216 O=C1C=CC(CNCc2ccccc2)=CN1 Amb27866225 [0,1,0,0,0,0|2,0,0]=3 119 B17R2.216 O=C1C=CN(COCc2ccccc2)C=C1 Amb27485298 [0,1,0,0,0,0|1,0,0]=2 120 B17R2.216 Oc1ccc(CNCc2ccccc2)cc1 Amb6687336 [0,1,0,0,0,0|1,0,0]=2 121 B17R2.216 Oc1ccc(CNCc2ccccn2)cc1 Amb6699014 [0,1,0,0,0,0|2,0,0]=3 122 B17R2.216 Oc1ccc(CNCc2cccnc2)cc1 Amb6729778 [0,1,0,0,0,0|2,0,0]=3 123 B17R2.216 Oc1ccc(CNCc2ccncc2)cc1 Amb6729559 [0,1,0,0,0,0|2,0,0]=3 124 B17R2.216 Oc1ccc(NCCc2ccccc2)cc1 Amb33548437 [0,1,0,0,0,0|2,0,0]=3 125 B17R2.216 Oc1ccc(NCCc2ccccc2)cc1 Amb9608650 [0,1,0,0,0,0|2,0,0]=3 126 B17R2.216 Oc1ccc(OCCc2ccccc2)cc1 Amb9210954 [0,1,0,0,0,0|2,0,0]=3 127 B17R2.216 Oc1ccc(\C=N\Cc2ccccc2)cc1 Amb4297814 [0,1,0,0,0,0|1,0,1]=3 128 B17R2.216 [O-][n+]1ccc(CCCc2ccccc2)cc1 Amb2694604 [0,1,0,0,0,0|2,0,0]=3 129 B17R2.2342 Br\C(=N/Nc1ccccc1)c2ccccc2 Amb10563287 [0,1,0,0,0,0|2,0,1]=4 130 B17R2.2342 CC(CCc1ccccc1)c2ccccc2 Amb23437762 [0,1,0,0,0,0|1,0,0]=2 131 B17R2.2342 CC(NCc1ccccc1)c2ccccc2 Amb21959684 [0,1,0,0,0,0|1,0,0]=2 132 B17R2.2342 CC(NCc1ccccc1)c2ccccc2 Amb9743575 [0,1,0,0,0,0|1,0,0]=2 133 B17R2.2342 CC(NCc1ccccc1)c2ccccn2 Amb9743592 [0,1,0,0,0,0|2,0,0]=3 134 B17R2.2342 CC(NCc1ccccn1)c2ccccc2 Amb2690283 [0,1,0,0,0,0|2,0,0]=3 135 B17R2.2342 CC(NCc1cccnc1)c2ccccc2 Amb837833 [0,1,0,0,0,0|2,0,0]=3 136 B17R2.2342 CC(NCc1ccncc1)c2ccccc2 Amb1551290 [0,1,0,0,0,0|2,0,0]=3 137 B17R2.2342 CC(OCc1ccccc1)c2ccccc2 Amb28141227 [0,1,0,0,0,0|0,0,0]=1 138 B17R2.2342 CC(\C=C\c1ccccc1)c2ccccc2 Amb17673649 [0,1,0,0,0,0|1,0,1]=3 139 B17R2.2342 CN(CCc1ccccn1)c2ccccc2 Amb24096770 [0,1,0,0,0,0|3,0,0]=4 140 B17R2.2342 C[C@@H](NCc1ccccc1)c2ccccc2 Amb2719978 [0,1,0,0,0,0|1,0,0]=2 141 B17R2.2342 C[C@@H](NCc1ccccc1)c2ccccc2 Amb3939870 [0,1,0,0,0,0|1,0,0]=2 142 B17R2.2342 C[C@H](NCc1ccccc1)c2ccccc2 Amb2786750 [0,1,0,0,0,0|1,0,0]=2 143 B17R2.2342 C[C@H](NCc1ccccc1)c2ccccc2 Amb32663250 [0,1,0,0,0,0|1,0,0]=2 144 B17R2.2342 C\C(=N/Nc1ccccc1)c2ccccc2 Amb16225041 [0,1,0,0,0,0|2,0,1]=4 145 B17R2.2342 ClC(\C=C\c1ccccc1)c2ccccc2 Amb24121369 [0,1,0,0,0,0|1,0,1]=3 146 B17R2.2342 Cl\C(=N/Nc1ccccc1)c2ccccc2 Amb2780895 [0,1,0,0,0,0|2,0,1]=4 147 B17R2.2342 Cl\C(=N\Cc1ccccc1)c2ccccc2 Amb28400953 [0,1,0,0,0,0|1,0,1]=3 148 B17R2.2342 N=C(NCc1ccccc1)c2ccccc2 Amb23447124 [0,1,0,0,0,0|1,0,1]=3 149 B17R2.2342 NC(CCc1ccccc1)c2ccccc2 Amb10609173 [0,1,0,0,0,0|1,0,0]=2 150 B17R2.2342 NC(CCc1ccccc1)c2ccccc2 Amb5737005 [0,1,0,0,0,0|1,0,0]=2 151 B17R2.2342 NC(CCc1ccccc1)c2ccccn2 Amb19003585 [0,1,0,0,0,0|2,0,0]=3 152 B17R2.2342 NC(CCc1ccccc1)c2ccccn2 Amb35745689 [0,1,0,0,0,0|2,0,0]=3 153 B17R2.2342 NC(CCc1ccccc1)c2cccnc2 Amb18303480 [0,1,0,0,0,0|2,0,0]=3 154 B17R2.2342 NC(CCc1ccccc1)c2ccncc2 Amb18303481 [0,1,0,0,0,0|2,0,0]=3 155 B17R2.2342 NC(CCc1ccccc1)c2ccncc2 Amb35745688 [0,1,0,0,0,0|2,0,0]=3 156 B17R2.2342 NC(CCc1ccccc1)c2cnccn2 Amb18303483 [0,1,0,0,0,0|3,0,0]=4 157 B17R2.2342 NC(CCc1ccccc1)c2ncccn2 Amb18303484 [0,1,0,0,0,0|3,0,0]=4 158 B17R2.2342 NC(CNc1ccccc1)c2ccccc2 Amb19009672 [0,1,0,0,0,0|2,0,0]=3 159 B17R2.2342 NC(COc1ccccc1)c2ccccc2 Amb1139757 [0,1,0,0,0,0|2,0,0]=3 160 B17R2.2342 NC(COc1ccccc1)c2ccccc2 Amb19341662 [0,1,0,0,0,0|2,0,0]=3 161 B17R2.2342 NC(CSc1ccccc1)c2ccccc2 Amb21988447 [0,1,0,0,0,0|2,0,0]=3 162 B17R2.2342 N[C@@H](CNc1ccccc1)c2ccccc2 Amb33838333 [0,1,0,0,0,0|2,0,0]=3 163 B17R2.2342 N\C(=N/Cc1ccccc1)c2cccnc2 Amb21970341 [0,1,0,0,0,0|2,0,1]=4 164 B17R2.2342 O=C(C#Cc1ccccc1)c2ccccc2 Amb3941702 [0,1,0,0,0,0|1,0,2]=4 165 B17R2.2342 O=C(CCc1ccccc1)c2ccccc2 Amb2228399 [0,1,0,0,0,0|1,0,1]=3 166 B17R2.2342 O=C(CCc1ccccc1)c2ccccn2 Amb17508111 [0,1,0,0,0,0|2,0,1]=4 167 B17R2.2342 O=C(CCc1ccccc1)c2cccnc2 Amb17240896 [0,1,0,0,0,0|2,0,1]=4 168 B17R2.2342 O=C(CCc1cccnc1)c2ccccc2 Amb17507860 [0,1,0,0,0,0|2,0,1]=4 169 B17R2.2342 O=C(CNc1ccccc1)c2ccccc2 Amb32929163 [0,1,0,0,0,0|2,0,1]=4 170 B17R2.2342 O=C(CNc1ccccc1)c2ccccc2 Amb6543315 [0,1,0,0,0,0|2,0,1]=4 171 B17R2.2342 O=C(COc1ccccc1)c2ccccc2 Amb6360737 [0,1,0,0,0,0|2,0,1]=4 172 B17R2.2342 O=C(CSc1ccccc1)c2ccccc2 Amb2703541 [0,1,0,0,0,0|2,0,1]=4 173 B17R2.2342 O=C(NCc1ccccc1)c2ccccc2 Amb6339622 [0,1,0,0,0,0|1,0,1]=3 174 B17R2.2342 O=C(NCc1ccccc1)c2ccccn2 Amb1239907 [0,1,0,0,0,0|2,0,1]=4 175 B17R2.2342 O=C(NCc1ccccc1)c2cccnc2 Amb1195994 [0,1,0,0,0,0|2,0,1]=4 176 B17R2.2342 O=C(NCc1ccccc1)c2ccncc2 Amb6317618 [0,1,0,0,0,0|2,0,1]=4 177 B17R2.2342 O=C(NNc1ccccc1)c2ccccc2 Amb1229298 [0,1,0,0,0,0|2,0,1]=4 178 B17R2.2342 O=C(OCc1ccccc1)c2ccccc2 Amb4889094 [0,1,0,0,0,0|0,0,1]=2 179 B17R2.2342 O=C(OCc1ccccc1)c2cccnc2 Amb1548203 [0,1,0,0,0,0|1,0,1]=3 180 B17R2.2342 O=C(OCc1ccccc1)c2cnccn2 Amb27485988 [0,1,0,0,0,0|2,0,1]=4 181 B17R2.2342 O=C(OCc1ccccn1)c2ccccn2 Amb24085010 [0,1,0,0,0,0|2,0,1]=4 182 B17R2.2342 O=C(\C=C\c1ccccc1)c2ccccc2 Amb17777126 [0,1,0,0,0,0|1,0,2]=4 183 B17R2.2342 O=C(\C=C\c1ccccc1)c2ccccc2 Amb33716481 [0,1,0,0,0,0|1,0,2]=4 184 B17R2.2342 O=C(\C=C\c1ccccc1)c2ccccc2 Amb8513552 [0,1,0,0,0,0|1,0,2]=4 185 B17R2.2342 O=C(\N=N\c1ccccc1)c2ccccc2 Amb16231118 [0,1,0,0,0,0|2,0,1]=4 186 B17R2.2342 OC(CCc1ccccc1)c2ccccc2 Amb4019920 [0,1,0,0,0,0|1,0,0]=2 187 B17R2.2342 OC(CNc1ccccc1)c2ccccc2 Amb17140784 [0,1,0,0,0,0|2,0,0]=3 188 B17R2.2342 OC(CNc1ccccc1)c2ccccn2 Amb17140847 [0,1,0,0,0,0|3,0,0]=4 189 B17R2.2342 OC(CNc1ccccc1)c2cccnc2 Amb17140848 [0,1,0,0,0,0|3,0,0]=4 190 B17R2.2342 OC(CNc1ccccc1)c2ccncc2 Amb17140849 [0,1,0,0,0,0|3,0,0]=4 191 B17R2.2342 OC(COc1ccccc1)c2ccccc2 Amb22479800 [0,1,0,0,0,0|2,0,0]=3 192 B17R2.2342 OC(CSc1ccccc1)c2ccccc2 Amb21988442 [0,1,0,0,0,0|2,0,0]=3 193 B17R2.2342 OC(\C=C\c1ccccc1)c2ccccc2 Amb5493999 [0,1,0,0,0,0|1,0,1]=3 194 B17R2.2342 OC(\C=C\c1ccccc1)c2cccnc2 Amb23600230 [0,1,0,0,0,0|2,0,1]=4 195 B17R2.2342 ON(\C=C\c1ccccc1)c2ccccc2 Amb17778079 [0,1,0,0,0,0|2,0,1]=4 196 B17R2.2342 O[C@@H](CNc1ccccc1)c2ccccc2 Amb29838296 [0,1,0,0,0,0|2,0,0]=3 197 B17R2.2342 O[C@H](CNc1ccccc1)c2ccccc2 Amb28556777 [0,1,0,0,0,0|2,0,0]=3 198 B17R2.2342 S=C(NCc1ccccc1)c2ccccc2 Amb1212595 [0,1,0,0,0,0|1,0,1]=3 199 B17R2.2342 S=C(NCc1ccccc1)c2ccccn2 Amb6346046 [0,1,0,0,0,0|2,0,1]=4 200 B17R2.3956 Brc1ccccc1NCCc2ccccc2 Amb6696373 [0,1,0,0,0,0|2,0,0]=3 201 B17R2.3956 Brc1ccccc1OCCc2ccccc2 Amb6665082 [0,1,0,0,0,0|2,0,0]=3 202 B17R2.3956 Brc1ccccc1\C=N\Nc2ccccc2 Amb24092518 [0,1,0,0,0,0|2,0,1]=4 203 B17R2.3956 Brc1cccnc1COCc2ccccc2 Amb27215867 [0,1,0,0,0,0|1,0,0]=2 204 B17R2.3956 Cc1ccccc1CNCc2ccccc2 Amb6687345 [0,1,0,0,0,0|1,0,0]=2 205 B17R2.3956 Cc1ccccc1CNCc2ccccn2 Amb15702952 [0,1,0,0,0,0|2,0,0]=3 206 B17R2.3956 Cc1ccccc1CNCc2ccccn2 Amb2689360 [0,1,0,0,0,0|2,0,0]=3 207 B17R2.3956 Cc1ccccc1CNCc2cccnc2 Amb6355621 [0,1,0,0,0,0|2,0,0]=3 208 B17R2.3956 Cc1ccccc1CNCc2ccncc2 Amb6356681 [0,1,0,0,0,0|2,0,0]=3 209 B17R2.3956 Cc1ccccc1NCCc2ccccc2 Amb4358612 [0,1,0,0,0,0|2,0,0]=3 210 B17R2.3956 Cc1ccccc1NCCc2ccccn2 Amb2777989 [0,1,0,0,0,0|3,0,0]=4 211 B17R2.3956 Cc1cccnc1CNCc2ccccc2 Amb13949059 [0,1,0,0,0,0|2,0,0]=3 212 B17R2.3956 Cc1cccnc1CNCc2ccccc2 Amb5559957 [0,1,0,0,0,0|2,0,0]=3 213 B17R2.3956 Cc1cccnc1CNCc2cccnc2 Amb5501629 [0,1,0,0,0,0|3,0,0]=4 214 B17R2.3956 Clc1ccccc1CNCc2ccccc2 Amb6364680 [0,1,0,0,0,0|1,0,0]=2 215 B17R2.3956 Clc1ccccc1CNCc2ccccn2 Amb6352474 [0,1,0,0,0,0|2,0,0]=3 216 B17R2.3956 Clc1ccccc1CNCc2cccnc2 Amb6364681 [0,1,0,0,0,0|2,0,0]=3 217 B17R2.3956 Clc1ccccc1CNCc2ccncc2 Amb838186 [0,1,0,0,0,0|2,0,0]=3 218 B17R2.3956 Clc1ccccc1NCCc2ccccc2 Amb6610978 [0,1,0,0,0,0|2,0,0]=3 219 B17R2.3956 Clc1cnccc1CNCc2ccncc2 Amb32757445 [0,1,0,0,0,0|3,0,0]=4 220 B17R2.3956 Clc1ncccc1CNCc2ccccc2 Amb25372702 [0,1,0,0,0,0|2,0,0]=3 221 B17R2.3956 Fc1ccccc1CNCc2ccccc2 Amb6352459 [0,1,0,0,0,0|1,0,0]=2 222 B17R2.3956 Fc1ccccc1CNCc2ccccn2 Amb6355715 [0,1,0,0,0,0|2,0,0]=3 223 B17R2.3956 Fc1ccccc1CNCc2cccnc2 Amb6355612 [0,1,0,0,0,0|2,0,0]=3 224 B17R2.3956 Fc1ccccc1CNCc2ccncc2 Amb6697918 [0,1,0,0,0,0|2,0,0]=3 225 B17R2.3956 Fc1ccccc1NCCc2ccccc2 Amb6697268 [0,1,0,0,0,0|2,0,0]=3 226 B17R2.3956 Nc1ccccc1CNCc2ccccc2 Amb19010879 [0,1,0,0,0,0|1,0,0]=2 227 B17R2.3956 Nc1ccccc1COCc2ccccc2 Amb6244669 [0,1,0,0,0,0|0,0,0]=1 228 B17R2.3956 Nc1ccccc1NCCc2ccccc2 Amb1103711 [0,1,0,0,0,0|2,0,0]=3 229 B17R2.3956 Nc1ccccc1NCCc2ccccc2 Amb2603080 [0,1,0,0,0,0|2,0,0]=3 230 B17R2.3956 Nc1ccccc1NCCc2ccccn2 Amb7767418 [0,1,0,0,0,0|3,0,0]=4 231 B17R2.3956 Nc1ccccc1NCCc2ccncc2 Amb19009293 [0,1,0,0,0,0|3,0,0]=4 232 B17R2.3956 Nc1ccccc1NNCc2ccccc2 Amb27248419 [0,1,0,0,0,0|2,0,0]=3 233 B17R2.3956 Nc1ccccc1OCCc2ccccc2 Amb1112568 [0,1,0,0,0,0|2,0,0]=3 234 B17R2.3956 Nc1ccccc1OCCc2ccccn2 Amb1995312 [0,1,0,0,0,0|3,0,0]=4 235 B17R2.3956 Nc1ccccc1OCCc2ccccn2 Amb7793980 [0,1,0,0,0,0|3,0,0]=4 236 B17R2.3956 Nc1ccccc1\C=N\Nc2ccccc2 Amb20665806 [0,1,0,0,0,0|2,0,1]=4 237 B17R2.3956 Nc1cccnc1NCCc2ccccc2 Amb7767925 [0,1,0,0,0,0|3,0,0]=4 238 B17R2.3956 Nc1cccnc1OCCc2ccccc2 Amb7790210 [0,1,0,0,0,0|3,0,0]=4 239 B17R2.3956 Nc1ccncc1CNCc2ccccc2 Amb27969199 [0,1,0,0,0,0|2,0,0]=3 240 B17R2.3956 Nc1cnccc1CNCc2ccccc2 Amb22751233 [0,1,0,0,0,0|2,0,0]=3 241 B17R2.3956 Nc1cnccc1NCCc2ccccc2 Amb24077828 [0,1,0,0,0,0|3,0,0]=4 242 B17R2.3956 Nc1cnccc1NCCc2ccccc2 Amb7767920 [0,1,0,0,0,0|3,0,0]=4 243 B17R2.3956 Nc1ncccc1OCCc2ccccc2 Amb7787280 [0,1,0,0,0,0|3,0,0]=4 244 B17R2.3956 Oc1ccccc1CNCc2ccccc2 Amb2781942 [0,1,0,0,0,0|1,0,0]=2 245 B17R2.3956 Oc1ccccc1CNCc2ccccn2 Amb33527557 [0,1,0,0,0,0|2,0,0]=3 246 B17R2.3956 Oc1ccccc1CNCc2cccnc2 Amb6729815 [0,1,0,0,0,0|2,0,0]=3 247 B17R2.3956 Oc1ccccc1CNCc2ccncc2 Amb6729601 [0,1,0,0,0,0|2,0,0]=3 248 B17R2.3956 Oc1ccccc1COCc2ccccc2 Amb27859423 [0,1,0,0,0,0|0,0,0]=1 249 B17R2.3956 Oc1ccccc1C\C=C\c2ccccc2 Amb1806020 [0,1,0,0,0,0|1,0,1]=3 250 B17R2.3956 Oc1ccccc1OCCc2ccccc2 Amb9210976 [0,1,0,0,0,0|2,0,0]=3 251 B17R2.3956 Oc1ccccc1\C=N\Cc2ccccc2 Amb576127 [0,1,0,0,0,0|1,0,1]=3 252 B17R2.3956 Oc1ccccc1\C=N\Nc2ccccc2 Amb6538801 [0,1,0,0,0,0|2,0,1]=4 253 B17R2.5301 Brc1cccc(CNCc2ccccc2)c1 Amb22588026 [0,1,0,0,0,0|1,0,0]=2 254 B17R2.5301 Brc1cccc(CNCc2ccccc2)c1 Amb6687338 [0,1,0,0,0,0|1,0,0]=2 255 B17R2.5301 Brc1cccc(CNCc2ccccc2)n1 Amb28422591 [0,1,0,0,0,0|2,0,0]=3 256 B17R2.5301 Brc1cccc(CNCc2ccccn2)c1 Amb6456043 [0,1,0,0,0,0|2,0,0]=3 257 B17R2.5301 Brc1cccc(CNCc2cccnc2)c1 Amb837881 [0,1,0,0,0,0|2,0,0]=3 258 B17R2.5301 Brc1cccc(CNCc2ccncc2)c1 Amb6465188 [0,1,0,0,0,0|2,0,0]=3 259 B17R2.5301 Brc1cccc(COCc2ccccc2)n1 Amb27484935 [0,1,0,0,0,0|1,0,0]=2 260 B17R2.5301 Brc1cccc(NCCc2ccccc2)c1 Amb6696593 [0,1,0,0,0,0|2,0,0]=3 261 B17R2.5301 Brc1cccc(OCCc2ccccc2)c1 Amb6628830 [0,1,0,0,0,0|2,0,0]=3 262 B17R2.5301 Brc1cncc(COCc2ccccc2)c1 Amb27222014 [0,1,0,0,0,0|1,0,0]=2 263 B17R2.5301 Cc1cccc(CNCc2ccccc2)c1 Amb1833778 [0,1,0,0,0,0|1,0,0]=2 264 B17R2.5301 Cc1cccc(CNCc2ccccc2)c1 Amb6335361 [0,1,0,0,0,0|1,0,0]=2 265 B17R2.5301 Cc1cccc(CNCc2ccccc2)n1 Amb13949058 [0,1,0,0,0,0|2,0,0]=3 266 B17R2.5301 Cc1cccc(CNCc2ccccc2)n1 Amb5501628 [0,1,0,0,0,0|2,0,0]=3 267 B17R2.5301 Cc1cccc(CNCc2ccccn2)c1 Amb15702953 [0,1,0,0,0,0|2,0,0]=3 268 B17R2.5301 Cc1cccc(CNCc2ccccn2)c1 Amb6699029 [0,1,0,0,0,0|2,0,0]=3 269 B17R2.5301 Cc1cccc(CNCc2cccnc2)c1 Amb6355622 [0,1,0,0,0,0|2,0,0]=3 270 B17R2.5301 Cc1cccc(CNCc2ccncc2)c1 Amb6728547 [0,1,0,0,0,0|2,0,0]=3 271 B17R2.5301 Cc1cccc(NCCc2ccccc2)c1 Amb6684422 [0,1,0,0,0,0|2,0,0]=3 272 B17R2.5301 Cc1nccc(CNCc2ccccc2)n1 Amb19007853 [0,1,0,0,0,0|3,0,0]=4 273 B17R2.5301 Clc1cc(CNCc2ccccc2)ccn1 Amb27750704 [0,1,0,0,0,0|2,0,0]=3 274 B17R2.5301 Clc1cc(COCc2ccccc2)ccn1 Amb27611493 [0,1,0,0,0,0|1,0,0]=2 275 B17R2.5301 Clc1cc(COCc2ccccc2)ncn1 Amb19516080 [0,1,0,0,0,0|2,0,0]=3 276 B17R2.5301 Clc1cccc(CNCc2ccccc2)c1 Amb1923462 [0,1,0,0,0,0|1,0,0]=2 277 B17R2.5301 Clc1cccc(CNCc2ccccn2)c1 Amb1838736 [0,1,0,0,0,0|2,0,0]=3 278 B17R2.5301 Clc1cccc(CNCc2cccnc2)c1 Amb6352462 [0,1,0,0,0,0|2,0,0]=3 279 B17R2.5301 Clc1cccc(CNCc2ccncc2)c1 Amb1923502 [0,1,0,0,0,0|2,0,0]=3 280 B17R2.5301 Clc1cccc(COCc2ccccc2)n1 Amb27407587 [0,1,0,0,0,0|1,0,0]=2 281 B17R2.5301 Clc1cccc(NCCc2ccccc2)c1 Amb6649485 [0,1,0,0,0,0|2,0,0]=3 282 B17R2.5301 Fc1cccc(CNCc2ccccc2)c1 Amb6352465 [0,1,0,0,0,0|1,0,0]=2 283 B17R2.5301 Fc1cccc(CNCc2ccccn2)c1 Amb6699027 [0,1,0,0,0,0|2,0,0]=3 284 B17R2.5301 Fc1cccc(NCCc2ccccc2)c1 Amb6695783 [0,1,0,0,0,0|2,0,0]=3 285 B17R2.5301 Ic1cccc(CNCc2ccccc2)c1 Amb26550498 [0,1,0,0,0,0|1,0,0]=2 286 B17R2.5301 Nc1cc(CCCc2ccccc2)ccn1 Amb24094447 [0,1,0,0,0,0|2,0,0]=3 287 B17R2.5301 Nc1cc(COCc2ccccc2)ccn1 Amb18311838 [0,1,0,0,0,0|1,0,0]=2 288 B17R2.5301 Nc1cccc(CCCc2ccccc2)c1 Amb13952732 [0,1,0,0,0,0|1,0,0]=2 289 B17R2.5301 Nc1cccc(COCc2ccccc2)c1 Amb2699336 [0,1,0,0,0,0|0,0,0]=1 290 B17R2.5301 Nc1cccc(CSCc2ccccc2)c1 Amb6676518 [0,1,0,0,0,0|0,1,0]=2 291 B17R2.5301 Nc1cccc(OCCc2ccccc2)c1 Amb1119309 [0,1,0,0,0,0|2,0,0]=3 292 B17R2.5301 Nc1cccc(OCCc2ccccc2)c1 Amb2111108 [0,1,0,0,0,0|2,0,0]=3 293 B17R2.5301 Nc1cccc(OCCc2ccccn2)c1 Amb1995305 [0,1,0,0,0,0|3,0,0]=4 294 B17R2.5301 Nc1cccc(OCCc2ccccn2)c1 Amb8009862 [0,1,0,0,0,0|3,0,0]=4 295 B17R2.5301 Nc1cccc(OCCc2cccnc2)c1 Amb17241675 [0,1,0,0,0,0|3,0,0]=4 296 B17R2.5301 Nc1ccnc(NCCc2ccccc2)c1 Amb17340020 [0,1,0,0,0,0|3,0,0]=4 297 B17R2.5301 Nc1ncnc(COCc2ccccc2)n1 Amb28072219 [0,1,0,0,0,0|3,0,0]=4 298 B17R2.5301 O=C1C=CN=C(COCc2ccccc2)N1 Amb27965238 [0,1,0,0,0,0|2,0,0]=3 299 B17R2.5301 O=C1C=CN[C@H](COCc2ccccc2)C1 Amb27751352 [0,1,0,0,0,0|1,0,2]=4 300 B17R2.5301 O=C1C=COC(COCc2ccccc2)C1 Amb28320987 [0,1,0,0,0,0|1,0,2]=4 301 B17R2.5301 Oc1cc(COCc2ccccc2)ncn1 Amb22167140 [0,1,0,0,0,0|2,0,0]=3 302 B17R2.5301 Oc1cccc(CNCc2ccccc2)c1 Amb6687458 [0,1,0,0,0,0|1,0,0]=2 303 B17R2.5301 Oc1cccc(CNCc2ccccn2)c1 Amb6699165 [0,1,0,0,0,0|2,0,0]=3 304 B17R2.5301 Oc1cccc(CNCc2cccnc2)c1 Amb4552899 [0,1,0,0,0,0|2,0,0]=3 305 B17R2.5301 Oc1cccc(CNCc2ccncc2)c1 Amb6729691 [0,1,0,0,0,0|2,0,0]=3 306 B17R2.5301 Oc1cccc(OCCc2ccccc2)c1 Amb8837429 [0,1,0,0,0,0|2,0,0]=3 307 B17R2.5301 Oc1cccc(\C=N\Cc2ccccc2)c1 Amb8485956 [0,1,0,0,0,0|1,0,1]=3 308 B17R2.5301 S=C1C=CN=C(COCc2ccccc2)N1 Amb27862690 [0,1,0,0,0,0|2,0,0]=3 309 B15R1.35 C\C=C\C=C/CCNCc1ccccc1 Amb27850580 [0,0,1,0,0,0|1,0,2]=4 310 B17R3.8 C1=C(c2ccccc2)c3ccccc3C1 Amb17778883 [0,0,0,1,0,0|1,0,1]=3 311 B17R3.8 C1=CC(c2ccccc2)c3ccccc31 Amb20240702 [0,0,0,1,0,0|1,0,1]=3 312 B17R3.8 c1ccc(-c2coc3ccccc23)cc1 Amb10067083 [0,0,0,1,0,0|2,0,1]=4 313 B17R3.8 c1ccc(-n2ccc3ccccc32)cc1 Amb8388379 [0,0,0,1,0,0|2,0,1]=4 314 B17R3.8 c1ccc(-n2cnc3ccccc32)cc1 Amb2700555 [0,0,0,1,0,0|3,0,0]=4 315 B17R3.8 c1ccc(-n2ncc3ccccc32)cc1 Amb4006218 [0,0,0,1,0,0|2,0,1]=4 316 B17R3.8 c1ccc(-n2nnc3ccccc32)cc1 Amb2622119 [0,0,0,1,0,0|3,0,0]=4 317 B17R3.8 c1ccc(C2CNc3ccccc32)cc1 Amb32882496 [0,0,0,1,0,0|2,0,0]=3 318 B17R3.8 c1ccc(C2NCc3ccccc32)cc1 Amb31135052 [0,0,0,1,0,0|1,0,0]=2 319 B17R3.8 c1ccc(C2NCc3cnccc32)cc1 Amb18188884 [0,0,0,1,0,0|2,0,0]=3 320 B17R3.8 c1ccc(N2CCc3ccccc32)cc1 Amb8392756 [0,0,0,1,0,0|2,0,0]=3 321 B17R3.8 c1ccc(N2CCc3ccccc32)nc1 Amb18452566 [0,0,0,1,0,0|3,0,0]=4 322 B17R3.1927 c1ccc(C2CC2c3ccccc3)cc1 Amb4302622 [0,0,0,1,0,0|1,0,0]=2 323 B17R3.1927 c1ccc(C2OC2c3ccccc3)cc1 Amb2610165 [0,0,0,1,0,0|0,0,0]=1 324 B17R3.1927 c1ccc([C@@H]2O[C@H]2c3ccccc3)cc1 Amb8513314 [0,0,0,1,0,0|0,0,0]=1 325 B17R3.1927 c1ccc([C@H]2O[C@@H]2c3ccccc3)cc1 Amb8629192 [0,0,0,1,0,0|0,0,0]=1 326 B17R3.1939 c1ccc(CC2Cc3ccccc32)cc1 Amb17778868 [0,0,0,1,0,0|1,0,0]=2 327 B17R3.1963 C1=Cc2ccccc2-c3ccccc3N1 Amb33948453 [0,0,0,1,0,0|2,0,1]=4 328 B17R3.1963 c1ccc-2c(c1)CCNc3ccccc32 Amb19375172 [0,0,0,1,0,0|2,0,0]=3 329 B17R3.1963 c1ccc-2c(c1)CNCc3ccccc32 Amb13952599 [0,0,0,1,0,0|1,0,0]=2 330 B17R3.1963 c1ccc-2c(c1)CNCc3ccccc32 Amb6740263 [0,0,0,1,0,0|1,0,0]=2 331 B15R2.2195 C(#Cc1ccccc1)c2ccccc2 Amb8390026 [0,0,0,0,1,0|0,0,2]=3 332 B15R2.2195 C(#Cc1cccnc1)c2ccccc2 Amb8388336 [0,0,0,0,1,0|1,0,2]=4 333 B15R2.2195 C(=C/c1ccccc1)/c2ccccc2 Amb16192901 [0,0,0,0,1,0|0,0,2]=3 334 B15R2.2195 C(=C\c1ccccc1)/c2ccccc2 Amb18511865 [0,0,0,0,1,0|0,0,2]=3 335 B15R2.2195 C(=C\c1ccccn1)/c2ccccc2 Amb6430521 [0,0,0,0,1,0|1,0,2]=4 336 B15R2.2195 C(=C\c1cccnc1)/c2ccccc2 Amb5718974 [0,0,0,0,1,0|1,0,2]=4 337 B15R2.2195 C(=C\c1ccncc1)/c2ccccc2 Amb2226978 [0,0,0,0,1,0|1,0,2]=4 338 B15R2.2195 C(=N\c1ccccc1)/c2ccccc2 Amb32411825 [0,0,0,0,1,0|1,0,1]=3 339 B15R2.2195 C(=N\c1ccccc1)/c2ccccn2 Amb25173927 [0,0,0,0,1,0|2,0,1]=4 340 B15R2.2195 C(=N\c1ccccc1)/c2ccncc2 Amb3693127 [0,0,0,0,1,0|2,0,1]=4 341 B15R2.2195 C1=COC(OCc2ccccc2)C=C1 Amb4011814 [0,0,0,0,1,0|1,0,1]=3 342 B15R2.2195 c1cc(CCc2ccncc2)ccn1 Amb6336326 [0,0,0,0,1,0|2,0,0]=3 343 B15R2.2195 c1cc[n+](CC[n+]2ccccc2)cc1 Amb2221672 [0,0,0,0,1,0|2,0,0]=3 344 B15R2.2195 c1ccc(CCc2ccccc2)cc1 Amb17678850 [0,0,0,0,1,0|0,0,0]=1 345 B15R2.2195 c1ccc(CCc2ccccn2)cc1 Amb5494186 [0,0,0,0,1,0|1,0,0]=2 346 B15R2.2195 c1ccc(CCc2ccccn2)nc1 Amb2713299 [0,0,0,0,1,0|2,0,0]=3 347 B15R2.2195 c1ccc(CCc2cccnc2)nc1 Amb6769550 [0,0,0,0,1,0|2,0,0]=3 348 B15R2.2195 c1ccc(CCc2ccncc2)cc1 Amb2612998 [0,0,0,0,1,0|1,0,0]=2 349 B15R2.2195 c1ccc(CCc2cnccn2)cc1 Amb15695191 [0,0,0,0,1,0|2,0,0]=3 350 B15R2.2195 c1ccc(CNc2ccccc2)cc1 Amb6355841 [0,0,0,0,1,0|1,0,0]=2 351 B15R2.2195 c1ccc(CNc2ccccn2)cc1 Amb1087875 [0,0,0,0,1,0|2,0,0]=3 352 B15R2.2195 c1ccc(CNc2ccccn2)nc1 Amb6642874 [0,0,0,0,1,0|3,0,0]=4 353 B15R2.2195 c1ccc(CNc2cccnc2)cc1 Amb2383000 [0,0,0,0,1,0|2,0,0]=3 354 B15R2.2195 c1ccc(CNc2cccnc2)nc1 Amb6686655 [0,0,0,0,1,0|3,0,0]=4 355 B15R2.2195 c1ccc(CNc2ccncc2)cc1 Amb597752 [0,0,0,0,1,0|2,0,0]=3 356 B15R2.2195 c1ccc(CNc2ccncc2)nc1 Amb6656695 [0,0,0,0,1,0|3,0,0]=4 357 B15R2.2195 c1ccc(CNc2ccncn2)cc1 Amb18973887 [0,0,0,0,1,0|3,0,0]=4 358 B15R2.2195 c1ccc(CNc2cnccn2)cc1 Amb2444500 [0,0,0,0,1,0|3,0,0]=4 359 B15R2.2195 c1ccc(CNc2cncnc2)cc1 Amb2612437 [0,0,0,0,1,0|3,0,0]=4 360 B15R2.2195 c1ccc(COc2ccccc2)cc1 Amb24097492 [0,0,0,0,1,0|0,0,0]=1 361 B15R2.2195 c1ccc(COc2ccccc2)cc1 Amb2691207 [0,0,0,0,1,0|0,0,0]=1 362 B15R2.2195 c1ccc(COc2ccccn2)cc1 Amb16191945 [0,0,0,0,1,0|1,0,0]=2 363 B15R2.2195 c1ccc(COc2cccnc2)cc1 Amb21927728 [0,0,0,0,1,0|1,0,0]=2 364 B15R2.2195 c1ccc(COc2cccnc2)nc1 Amb27236662 [0,0,0,0,1,0|2,0,0]=3 365 B15R2.2195 c1ccc(COc2ccncc2)cc1 Amb10603750 [0,0,0,0,1,0|1,0,0]=2 366 B15R2.2195 c1ccc(COc2cncnc2)cc1 Amb24098649 [0,0,0,0,1,0|2,0,0]=3 367 B15R2.2195 c1ccc(CSc2ccccc2)cc1 Amb2684670 [0,0,0,0,1,0|0,1,0]=2 368 B15R2.2195 c1ccc(CSc2ccccn2)cc1 Amb3862159 [0,0,0,0,1,0|1,1,0]=3 369 B15R2.2195 c1ccc(CSc2cccnn2)cc1 Amb25785634 [0,0,0,0,1,0|2,1,0]=4 370 B15R2.2195 c1ccc(CSc2ncccn2)cc1 Amb1263972 [0,0,0,0,1,0|2,1,0]=4 371 B15R2.2195 c1ccc(C[SiH2]c2ccccc2)cc1 Amb22347054 [0,0,0,0,1,0|0,1,0]=2 372 B15R2.2195 c1ccc(NCc2ccccn2)cc1 Amb6356069 [0,0,0,0,1,0|2,0,0]=3 373 B15R2.2195 c1ccc(NCc2cccnc2)cc1 Amb6356070 [0,0,0,0,1,0|2,0,0]=3 374 B15R2.2195 c1ccc(NCc2cccnc2)nc1 Amb2694194 [0,0,0,0,1,0|3,0,0]=4 375 B15R2.2195 c1ccc(NCc2ccncc2)cc1 Amb6356071 [0,0,0,0,1,0|2,0,0]=3 376 B15R2.2195 c1ccc(NCc2ccncc2)nc1 Amb6609621 [0,0,0,0,1,0|3,0,0]=4 377 B15R2.2195 c1ccc(NCc2cncnc2)cc1 Amb18996444 [0,0,0,0,1,0|3,0,0]=4 378 B15R2.2195 c1ccc(NNc2ccccc2)cc1 Amb28990937 [0,0,0,0,1,0|2,0,0]=3 379 B15R2.2195 c1ccc(NNc2ccccc2)cc1 Amb4000296 [0,0,0,0,1,0|2,0,0]=3 380 B15R2.2195 c1ccc(OCc2cccnc2)cc1 Amb27465872 [0,0,0,0,1,0|1,0,0]=2 381 B15R2.2195 c1ccc(OCc2ccncc2)cc1 Amb27217814 [0,0,0,0,1,0|1,0,0]=2 382 B15R2.2195 c1ccc(OCc2cnccn2)cc1 Amb35700555 [0,0,0,0,1,0|2,0,0]=3 383 B15R2.2195 c1ccc(OCc2ncccn2)cc1 Amb27181427 [0,0,0,0,1,0|2,0,0]=3 384 B15R2.2195 c1ccc(SC[n+]2ccccc2)cc1 Amb10568955 [0,0,0,0,1,0|1,1,0]=3 385 B15R2.2195 c1ccc(SCc2cccnc2)cc1 Amb10632429 [0,0,0,0,1,0|1,1,0]=3 386 B15R2.2195 c1ccc(SCc2cccnc2)nc1 Amb10710736 [0,0,0,0,1,0|2,1,0]=4 387 B15R2.2195 c1ccc(SCc2ccncc2)nc1 Amb25776849 [0,0,0,0,1,0|2,1,0]=4 388 B15R2.2195 c1ccc(SSc2ccccc2)cc1 Amb2687663 [0,0,0,0,1,0|1,1,0]=3 389 B15R2.2195 c1ccc([Se][Se]c2ccccc2)cc1 Amb4138616 [0,0,0,0,1,0|1,1,0]=3 390 B15R2.2195 c1ccc([Te][Te]c2ccccc2)cc1 Amb6366598 [0,0,0,0,1,0|1,1,0]=3 391 B15R2.2195 c1ccc(\N=N/c2ccccc2)cc1 Amb10843899 [0,0,0,0,1,0|2,0,0]=3 392 B15R2.2195 c1ccc(\N=N\c2ccccc2)cc1 Amb4408423 [0,0,0,0,1,0|2,0,0]=3 393 B15R2.2195 c1cncc(CNc2cccnc2)c1 Amb6686503 [0,0,0,0,1,0|3,0,0]=4 394 B15R2.2195 c1cncc(CNc2ccncc2)c1 Amb6614340 [0,0,0,0,1,0|3,0,0]=4 395 B15R2.2195 c1cncc(NCc2ccncc2)c1 Amb6686507 [0,0,0,0,1,0|3,0,0]=4 396 B15R2.2195 c1cncc(OCc2cnccn2)c1 Amb35722943 [0,0,0,0,1,0|3,0,0]=4 397 B15R2.2196 C(=N\Cc1cccs1)/c2ccccc2 Amb27812048 [0,0,0,0,1,0|2,0,1]=4 398 B15R2.2196 C1=CCC(COCc2ccccc2)C1 Amb27249539 [0,0,0,0,1,0|0,0,3]=4 399 B15R2.2196 c1ccc(CCNc2ccsc2)cc1 Amb28342737 [0,0,0,0,1,0|3,0,0]=4 400 B15R2.2196 c1ccc(CNCc2ccco2)cc1 Amb6335661 [0,0,0,0,1,0|2,0,0]=3 401 B15R2.2196 c1ccc(CNCc2ccco2)cc1 Amb6880630 [0,0,0,0,1,0|2,0,0]=3 402 B15R2.2196 c1ccc(CNCc2ccco2)nc1 Amb24053233 [0,0,0,0,1,0|3,0,0]=4 403 B15R2.2196 c1ccc(CNCc2ccco2)nc1 Amb6335681 [0,0,0,0,1,0|3,0,0]=4 404 B15R2.2196 c1ccc(CNCc2ccco2)nc1 Amb8468589 [0,0,0,0,1,0|3,0,0]=4 405 B15R2.2196 c1ccc(CNCc2cccs2)cc1 Amb24121220 [0,0,0,0,1,0|2,0,0]=3 406 B15R2.2196 c1ccc(CNCc2cccs2)cc1 Amb838211 [0,0,0,0,1,0|2,0,0]=3 407 B15R2.2196 c1ccc(CNCc2cccs2)nc1 Amb6699050 [0,0,0,0,1,0|3,0,0]=4 408 B15R2.2196 c1ccc(CNCc2ccoc2)cc1 Amb19006886 [0,0,0,0,1,0|2,0,0]=3 409 B15R2.2196 c1ccc(CNCc2ccsc2)nc1 Amb6699055 [0,0,0,0,1,0|3,0,0]=4 410 B15R2.2196 c1ccc(CNCc2cnco2)cc1 Amb19013447 [0,0,0,0,1,0|3,0,0]=4 411 B15R2.2196 c1ccc(CNCc2cncs2)cc1 Amb19030208 [0,0,0,0,1,0|3,0,0]=4 412 B15R2.2196 c1ccc(CNCc2ncco2)cc1 Amb25091033 [0,0,0,0,1,0|3,0,0]=4 413 B15R2.2196 c1ccc(CNCc2nccs2)cc1 Amb22586858 [0,0,0,0,1,0|3,0,0]=4 414 B15R2.2196 c1ccc(CNCc2nccs2)cc1 Amb2693224 [0,0,0,0,1,0|3,0,0]=4 415 B15R2.2196 c1ccc(COCc2cccs2)cc1 Amb27633430 [0,0,0,0,1,0|1,0,0]=2 416 B15R2.2196 c1ccc(COCc2cncs2)cc1 Amb2407241 [0,0,0,0,1,0|2,0,0]=3 417 B15R2.2196 c1ccc(COCc2nnco2)cc1 Amb24447437 [0,0,0,0,1,0|3,0,0]=4 418 B15R2.2196 c1ccc(COCc2nncs2)cc1 Amb27963381 [0,0,0,0,1,0|3,0,0]=4 419 B15R2.2196 c1ccc(COCn2ccnc2)cc1 Amb27182501 [0,0,0,0,1,0|2,0,0]=3 420 B15R2.2196 c1ccc(C[NH2+]Cc2ccco2)cc1 Amb33513212 [0,0,0,0,1,0|2,0,0]=3 421 B15R2.2196 c1ccc(NCCc2ccco2)cc1 Amb28135300 [0,0,0,0,1,0|3,0,0]=4 422 B15R2.2196 c1ccc(OCCn2cccc2)cc1 Amb17234429 [0,0,0,0,1,0|3,0,0]=4 423 B15R2.2196 c1cncc(CNCc2ccco2)c1 Amb5759054 [0,0,0,0,1,0|3,0,0]=4 424 B15R2.2196 c1cncc(CNCc2ccco2)c1 Amb6335674 [0,0,0,0,1,0|3,0,0]=4 425 B15R2.2196 c1cncc(CNCc2ccco2)c1 Amb6572588 [0,0,0,0,1,0|3,0,0]=4 426 B15R2.2196 c1cncc(CNCc2cccs2)c1 Amb6355734 [0,0,0,0,1,0|3,0,0]=4 427 B15R2.2196 c1cncc(CNCc2ccsc2)c1 Amb1094469 [0,0,0,0,1,0|3,0,0]=4 428 B15R2.2196 c1cncc(CNCc2ccsc2)c1 Amb6868334 [0,0,0,0,1,0|3,0,0]=4 429 B15R2.2196 c1coc(CNCc2ccncc2)c1 Amb22386843 [0,0,0,0,1,0|3,0,0]=4 430 B15R2.2196 c1coc(CNCc2ccncc2)c1 Amb6335682 [0,0,0,0,1,0|3,0,0]=4 431 B15R2.2196 c1coc(CNCc2ccncc2)c1 Amb8468590 [0,0,0,0,1,0|3,0,0]=4 432 B15R2.2196 c1coc(C[NH2+]Cc2ccncc2)c1 Amb33513219 [0,0,0,0,1,0|3,0,0]=4 433 B15R2.2196 c1csc(CNCc2ccncc2)c1 Amb838028 [0,0,0,0,1,0|3,0,0]=4 434 B17R2.2382 C(=C\c1ccccc1)/CNc2ccccn2 Amb17100159 [0,0,0,0,0,1|2,0,1]=4 435 B17R2.2382 C(=N\N=C\c1ccccc1)/c2ccccc2 Amb1419561 [0,0,0,0,0,1|1,0,2]=4 436 B17R2.2382 C(=N\OCc1ccccc1)/c2cccnc2 Amb24072697 [0,0,0,0,0,1|1,0,1]=3 437 B17R2.2382 C(C#Cc1ccccc1)#Cc2ccccc2 Amb17836434 [0,0,0,0,0,1|1,0,2]=4 438 B17R2.2382 C(\C=C\c1ccccc1)=C/c2ccccc2 Amb2458220 [0,0,0,0,0,1|1,0,2]=4 439 B17R2.2382 c1cc[n+](CCCC[n+]2ccccc2)cc1 Amb20668088 [0,0,0,0,0,1|3,0,0]=4 440 B17R2.2382 c1ccc(CCCNc2ccccc2)cc1 Amb4313446 [0,0,0,0,0,1|1,0,0]=2 441 B17R2.2382 c1ccc(CCCSc2ccccc2)cc1 Amb4010759 [0,0,0,0,0,1|1,0,0]=2 442 B17R2.2382 c1ccc(CCNCc2ccccc2)cc1 Amb1049050 [0,0,0,0,0,1|1,0,0]=2 443 B17R2.2382 c1ccc(CCNCc2ccccc2)cc1 Amb33439 [0,0,0,0,0,1|1,0,0]=2 444 B17R2.2382 c1ccc(CCNCc2ccccn2)cc1 Amb22279533 [0,0,0,0,0,1|2,0,0]=3 445 B17R2.2382 c1ccc(CCNCc2ccccn2)cc1 Amb838410 [0,0,0,0,0,1|2,0,0]=3 446 B17R2.2382 c1ccc(CCNCc2cccnc2)cc1 Amb15740914 [0,0,0,0,0,1|2,0,0]=3 447 B17R2.2382 c1ccc(CCNCc2cccnc2)cc1 Amb33527540 [0,0,0,0,0,1|2,0,0]=3 448 B17R2.2382 c1ccc(CCNCc2cccnc2)nc1 Amb6694375 [0,0,0,0,0,1|3,0,0]=4 449 B17R2.2382 c1ccc(CCNCc2ccncc2)cc1 Amb838157 [0,0,0,0,0,1|2,0,0]=3 450 B17R2.2382 c1ccc(CCNCc2ccncc2)nc1 Amb33473660 [0,0,0,0,0,1|3,0,0]=4 451 B17R2.2382 c1ccc(CCNCc2ccncc2)nc1 Amb6694381 [0,0,0,0,0,1|3,0,0]=4 452 B17R2.2382 c1ccc(CNCCc2ccccn2)cc1 Amb1397745 [0,0,0,0,0,1|2,0,0]=3 453 B17R2.2382 c1ccc(CNCCc2cccnc2)cc1 Amb27947338 [0,0,0,0,0,1|2,0,0]=3 454 B17R2.2382 c1ccc(CNCCc2ccncc2)cc1 Amb2592523 [0,0,0,0,0,1|2,0,0]=3 455 B17R2.2382 c1ccc(CNOCc2ccccc2)cc1 Amb27611604 [0,0,0,0,0,1|0,0,0]=1 456 B17R2.2382 c1ccc(CONCc2cccnc2)cc1 Amb28042688 [0,0,0,0,0,1|1,0,0]=2 457 B17R2.2382 c1ccc(CONCc2ccncc2)cc1 Amb28249603 [0,0,0,0,0,1|1,0,0]=2 458 B17R2.2382 c1ccc(CONCc2ccncn2)cc1 Amb27267750 [0,0,0,0,0,1|2,0,0]=3 459 B17R2.2382 c1ccc(CONCc2cnccn2)cc1 Amb28192646 [0,0,0,0,0,1|2,0,0]=3 460 B17R2.2382 c1ccc(CSSCc2ccccc2)cc1 Amb3978810 [0,0,0,0,0,1|0,1,0]=2 461 B17R2.2382 c1ccc(C[Se][Se]Cc2ccccc2)cc1 Amb8515143 [0,0,0,0,0,1|0,1,0]=2 462 B17R2.2382 c1ccc(NCCNc2ccccc2)cc1 Amb2720079 [0,0,0,0,0,1|2,0,0]=3 463 B17R2.2382 c1ccc(OCCNc2ccccn2)cc1 Amb17100119 [0,0,0,0,0,1|3,0,0]=4 464 B17R2.2382 c1ccc(OCCNc2ccncc2)cc1 Amb24186955 [0,0,0,0,0,1|3,0,0]=4 465 B17R2.2382 c1ccc(OCCOc2ccccc2)cc1 Amb6356501 [0,0,0,0,0,1|2,0,0]=3 466 B17R2.2382 c1ccc(SCCSc2ccccc2)cc1 Amb2684781 [0,0,0,0,0,1|2,0,0]=3 467 B17R2.2382 c1ccc(\N=N\NNc2ccccc2)cc1 Amb21953597 [0,0,0,0,0,1|3,0,0]=4 468 B14R1.123 O=C\C=C\C=C\NCc1ccccc1 Amb27632389 [1,0,1,0,0,0|2,0,0]=4 469 B14R1.123 O=C\C=C\CCOCc1ccccc1 Amb25785188 [1,0,1,0,0,0|1,0,1]=4 470 B14R1.123 O=C\C=C\OCOCc1ccccc1 Amb25224401 [1,0,1,0,0,0|2,0,0]=4 471 B14R1.520 C\C(=C\C=O)COCc1ccccc1 Amb27880589 [1,0,1,0,0,0|1,0,1]=4 472 B14R1.546 C\C=C(\C=O)COCc1ccccc1 Amb27171065 [1,0,1,0,0,0|1,0,1]=4 473 B16R2.71 BrC1=CNC=CC1OCc2ccccc2 Amb27491349 [0,1,0,0,1,0|1,0,1]=4 474 B16R2.71 Brc1ccccc1C#Cc2ccccc2 Amb8394446 [0,1,0,0,1,0|0,0,2]=4 475 B16R2.71 Brc1ccccc1CCc2ncccn2 Amb18230164 [0,1,0,0,1,0|2,0,0]=4 476 B16R2.71 Brc1ccccc1CNc2cccnc2 Amb6686658 [0,1,0,0,1,0|2,0,0]=4 477 B16R2.71 Brc1ccccc1COc2ccccc2 Amb2724080 [0,1,0,0,1,0|0,0,0]=2 478 B16R2.71 Brc1ccccc1CSc2ccccc2 Amb22265930 [0,1,0,0,1,0|0,1,0]=3 479 B16R2.71 Brc1ccccc1NCc2ccccc2 Amb6696457 [0,1,0,0,1,0|1,0,0]=3 480 B16R2.71 Brc1ccccc1NCc2ccccn2 Amb6696465 [0,1,0,0,1,0|2,0,0]=4 481 B16R2.71 Brc1ccccc1NCc2cccnc2 Amb6696374 [0,1,0,0,1,0|2,0,0]=4 482 B16R2.71 Brc1ccccc1NCc2ccncc2 Amb4002542 [0,1,0,0,1,0|2,0,0]=4 483 B16R2.71 Brc1ccccc1OCc2ccccc2 Amb6665080 [0,1,0,0,1,0|0,0,0]=2 484 B16R2.71 Brc1ccccc1OCc2ccccn2 Amb6256204 [0,1,0,0,1,0|1,0,0]=3 485 B16R2.71 Brc1ccccc1OCc2cccnc2 Amb6273762 [0,1,0,0,1,0|1,0,0]=3 486 B16R2.71 Brc1ccccc1OCc2cnccn2 Amb30018078 [0,1,0,0,1,0|2,0,0]=4 487 B16R2.71 Brc1cccnc1OCc2ccccc2 Amb21856407 [0,1,0,0,1,0|1,0,0]=3 488 B16R2.71 Brc1cccnc1OCc2cccnc2 Amb27434350 [0,1,0,0,1,0|2,0,0]=4 489 B16R2.71 Brc1cccnc1SCc2ccccc2 Amb27152053 [0,1,0,0,1,0|1,1,0]=4 490 B16R2.71 Brc1ccncc1OCc2ccccc2 Amb27209054 [0,1,0,0,1,0|1,0,0]=3 491 B16R2.71 Brc1cnccc1OCc2ccccc2 Amb27230531 [0,1,0,0,1,0|1,0,0]=3 492 B16R2.71 Brc1cnccc1SCc2ccccc2 Amb27976296 [0,1,0,0,1,0|1,1,0]=4 493 B16R2.71 Brc1ncccc1OCc2ccccc2 Amb13889959 [0,1,0,0,1,0|1,0,0]=3 494 B16R2.71 Brc1ncccc1OCc2ccccn2 Amb10601227 [0,1,0,0,1,0|2,0,0]=4 495 B16R2.71 Brc1ncccc1OCc2cccnc2 Amb10601228 [0,1,0,0,1,0|2,0,0]=4 496 B16R2.71 Brc1ncccc1OCc2ccncc2 Amb10601229 [0,1,0,0,1,0|2,0,0]=4 497 B16R2.71 Brc1ncncc1OCc2ccccc2 Amb27962395 [0,1,0,0,1,0|2,0,0]=4 498 B16R2.71 C[n+]1ccccc1OCc2ccccc2 Amb10601695 [0,1,0,0,1,0|1,0,0]=3 499 B16R2.71 Cc1ccccc1CNc2ccccc2 Amb4313317 [0,1,0,0,1,0|1,0,0]=3 500 B16R2.71 Cc1ccccc1CNc2cccnc2 Amb6686478 [0,1,0,0,1,0|2,0,0]=4 501 B16R2.71 Cc1ccccc1NCc2ccccc2 Amb11014339 [0,1,0,0,1,0|1,0,0]=3 502 B16R2.71 Cc1ccccc1NCc2ccccc2 Amb838871 [0,1,0,0,1,0|1,0,0]=3 503 B16R2.71 Cc1ccccc1NCc2ccccn2 Amb6701235 [0,1,0,0,1,0|2,0,0]=4 504 B16R2.71 Cc1ccccc1NCc2cccnc2 Amb6701128 [0,1,0,0,1,0|2,0,0]=4 505 B16R2.71 Cc1ccccc1NCc2ccncc2 Amb6286265 [0,1,0,0,1,0|2,0,0]=4 506 B16R2.71 Cc1ccccc1OCc2ccccc2 Amb2447370 [0,1,0,0,1,0|0,0,0]=2 507 B16R2.71 Cc1ccncc1NCc2ccccc2 Amb25170961 [0,1,0,0,1,0|2,0,0]=4 508 B16R2.71 Cc1ncccc1NCc2ccccc2 Amb26642123 [0,1,0,0,1,0|2,0,0]=4 509 B16R2.71 Clc1ccccc1CNc2ccccc2 Amb4313409 [0,1,0,0,1,0|1,0,0]=3 510 B16R2.71 Clc1ccccc1CNc2ccccn2 Amb2382990 [0,1,0,0,1,0|2,0,0]=4 511 B16R2.71 Clc1ccccc1CNc2cccnc2 Amb2383003 [0,1,0,0,1,0|2,0,0]=4 512 B16R2.71 Clc1ccccc1CNc2cccnc2 Amb24079952 [0,1,0,0,1,0|2,0,0]=4 513 B16R2.71 Clc1ccccc1CNc2ccncc2 Amb24079953 [0,1,0,0,1,0|2,0,0]=4 514 B16R2.71 Clc1ccccc1NCc2ccccc2 Amb4313268 [0,1,0,0,1,0|1,0,0]=3 515 B16R2.71 Clc1ccccc1NCc2ccccn2 Amb6696917 [0,1,0,0,1,0|2,0,0]=4 516 B16R2.71 Clc1ccccc1NCc2cccnc2 Amb6696851 [0,1,0,0,1,0|2,0,0]=4 517 B16R2.71 Clc1ccccc1NCc2ccncc2 Amb6696855 [0,1,0,0,1,0|2,0,0]=4 518 B16R2.71 Clc1ccccc1OCc2ccccc2 Amb28141643 [0,1,0,0,1,0|0,0,0]=2 519 B16R2.71 Clc1cccnc1NCc2ccccc2 Amb6638612 [0,1,0,0,1,0|2,0,0]=4 520 B16R2.71 Clc1ncccc1CNc2ccccc2 Amb16691142 [0,1,0,0,1,0|2,0,0]=4 521 B16R2.71 Clc1ncccc1NCc2ccccc2 Amb9555488 [0,1,0,0,1,0|2,0,0]=4 522 B16R2.71 Clc1ncccc1OCc2ccccc2 Amb2611987 [0,1,0,0,1,0|1,0,0]=3 523 B16R2.71 Clc1nccnc1CCc2ccccc2 Amb28125268 [0,1,0,0,1,0|2,0,0]=4 524 B16R2.71 Clc1nccnc1OCc2ccccc2 Amb28380927 [0,1,0,0,1,0|2,0,0]=4 525 B16R2.71 Clc1ncncc1OCc2ccccc2 Amb22234502 [0,1,0,0,1,0|2,0,0]=4 526 B16R2.71 Clc1nnccc1OCc2ccccc2 Amb23402477 [0,1,0,0,1,0|2,0,0]=4 527 B16R2.71 Fc1ccccc1CNc2ccccc2 Amb4304157 [0,1,0,0,1,0|1,0,0]=3 528 B16R2.71 Fc1ccccc1CNc2ccccn2 Amb6648620 [0,1,0,0,1,0|2,0,0]=4 529 B16R2.71 Fc1ccccc1CNc2ccncc2 Amb33545756 [0,1,0,0,1,0|2,0,0]=4 530 B16R2.71 Fc1ccccc1COc2cnccn2 Amb33619065 [0,1,0,0,1,0|2,0,0]=4 531 B16R2.71 Fc1ccccc1NCc2ccccc2 Amb33527612 [0,1,0,0,1,0|1,0,0]=3 532 B16R2.71 Fc1ccccc1NCc2ccccc2 Amb6697374 [0,1,0,0,1,0|1,0,0]=3 533 B16R2.71 Fc1ccccc1NCc2ccccn2 Amb6697384 [0,1,0,0,1,0|2,0,0]=4 534 B16R2.71 Fc1ccccc1NCc2cccnc2 Amb6697270 [0,1,0,0,1,0|2,0,0]=4 535 B16R2.71 Fc1ccccc1NCc2ccncc2 Amb6697275 [0,1,0,0,1,0|2,0,0]=4 536 B16R2.71 Fc1ccccc1OCc2ccccc2 Amb8392535 [0,1,0,0,1,0|0,0,0]=2 537 B16R2.71 Fc1cccnc1NCc2ccccc2 Amb18300631 [0,1,0,0,1,0|2,0,0]=4 538 B16R2.71 Fc1ncccc1NCc2ccccc2 Amb35693144 [0,1,0,0,1,0|2,0,0]=4 539 B16R2.71 Fc1ncccc1OCc2ccccc2 Amb27452907 [0,1,0,0,1,0|1,0,0]=3 540 B16R2.71 Fc1ncccc1OCc2ccncc2 Amb27805658 [0,1,0,0,1,0|2,0,0]=4 541 B16R2.71 Fc1nccnc1OCc2ccccc2 Amb35729165 [0,1,0,0,1,0|2,0,0]=4 542 B16R2.71 Ic1ccccc1COc2ccccc2 Amb32410434 [0,1,0,0,1,0|0,0,0]=2 543 B16R2.71 Ic1ccccc1NCc2ccccc2 Amb7760756 [0,1,0,0,1,0|1,0,0]=3 544 B16R2.71 Ic1ccccc1NCc2ccccn2 Amb9208194 [0,1,0,0,1,0|2,0,0]=4 545 B16R2.71 Ic1ccccc1NCc2cccnc2 Amb9208198 [0,1,0,0,1,0|2,0,0]=4 546 B16R2.71 Ic1ccccc1NCc2ccncc2 Amb9203694 [0,1,0,0,1,0|2,0,0]=4 547 B16R2.71 Ic1ccccc1OCc2ccccc2 Amb22232803 [0,1,0,0,1,0|0,0,0]=2 548 B16R2.71 Ic1ccccc1OCc2cccnc2 Amb27773280 [0,1,0,0,1,0|1,0,0]=3 549 B16R2.71 Ic1ccccc1OCc2ccncc2 Amb27486174 [0,1,0,0,1,0|1,0,0]=3 550 B16R2.71 Ic1ccccc1OCc2cnccn2 Amb35722523 [0,1,0,0,1,0|2,0,0]=4 551 B16R2.71 Ic1ccccc1OCc2ncccn2 Amb28342860 [0,1,0,0,1,0|2,0,0]=4 552 B16R2.71 Ic1cncnc1OCc2ccccc2 Amb27825036 [0,1,0,0,1,0|2,0,0]=4 553 B16R2.71 Nc1ccccc1C#Cc2ccccc2 Amb1772819 [0,1,0,0,1,0|0,0,2]=4 554 B16R2.71 Nc1ccccc1CCc2ccccc2 Amb17843031 [0,1,0,0,1,0|0,0,0]=2 555 B16R2.71 Nc1ccccc1CCc2ccccc2 Amb21954211 [0,1,0,0,1,0|0,0,0]=2 556 B16R2.71 Nc1ccccc1CCc2ccccn2 Amb1092119 [0,1,0,0,1,0|1,0,0]=3 557 B16R2.71 Nc1ccccc1CCc2cccnc2 Amb22011444 [0,1,0,0,1,0|1,0,0]=3 558 B16R2.71 Nc1ccccc1CCc2ccncc2 Amb1087951 [0,1,0,0,1,0|1,0,0]=3 559 B16R2.71 Nc1ccccc1CCc2ncccn2 Amb18864224 [0,1,0,0,1,0|2,0,0]=4 560 B16R2.71 Nc1ccccc1CNc2ccccc2 Amb18973315 [0,1,0,0,1,0|1,0,0]=3 561 B16R2.71 Nc1ccccc1CNc2ccccn2 Amb17100062 [0,1,0,0,1,0|2,0,0]=4 562 B16R2.71 Nc1ccccc1CNc2ccncc2 Amb18984737 [0,1,0,0,1,0|2,0,0]=4 563 B16R2.71 Nc1ccccc1COc2ccccc2 Amb2724081 [0,1,0,0,1,0|0,0,0]=2 564 B16R2.71 Nc1ccccc1NCc2ccccc2 Amb7764683 [0,1,0,0,1,0|1,0,0]=3 565 B16R2.71 Nc1ccccc1NCc2ccccn2 Amb9205292 [0,1,0,0,1,0|2,0,0]=4 566 B16R2.71 Nc1ccccc1NCc2cccnc2 Amb7768126 [0,1,0,0,1,0|2,0,0]=4 567 B16R2.71 Nc1ccccc1NCc2ccncc2 Amb7768116 [0,1,0,0,1,0|2,0,0]=4 568 B16R2.71 Nc1ccccc1NNc2ccccc2 Amb17777429 [0,1,0,0,1,0|2,0,0]=4 569 B16R2.71 Nc1ccccc1OCc2ccccc2 Amb1119599 [0,1,0,0,1,0|0,0,0]=2 570 B16R2.71 Nc1ccccc1OCc2ccccc2 Amb18369109 [0,1,0,0,1,0|0,0,0]=2 571 B16R2.71 Nc1ccccc1OCc2ccccn2 Amb1084282 [0,1,0,0,1,0|1,0,0]=3 572 B16R2.71 Nc1ccccc1OCc2ccccn2 Amb8503355 [0,1,0,0,1,0|1,0,0]=3 573 B16R2.71 Nc1ccccc1OCc2cccnc2 Amb22282186 [0,1,0,0,1,0|1,0,0]=3 574 B16R2.71 Nc1ccccc1OCc2cccnc2 Amb33536530 [0,1,0,0,1,0|1,0,0]=3 575 B16R2.71 Nc1ccccc1SCc2ccccc2 Amb1216619 [0,1,0,0,1,0|0,1,0]=3 576 B16R2.71 Nc1ccccc1SCc2ccccn2 Amb2889101 [0,1,0,0,1,0|1,1,0]=4 577 B16R2.71 Nc1ccccc1\C=C\c2ccccc2 Amb21947815 [0,1,0,0,1,0|0,0,2]=4 578 B16R2.71 Nc1cccnc1NCc2ccccc2 Amb7172721 [0,1,0,0,1,0|2,0,0]=4 579 B16R2.71 Nc1cccnc1OCc2ccccc2 Amb1136051 [0,1,0,0,1,0|1,0,0]=3 580 B16R2.71 Nc1ccncc1NCc2ccccc2 Amb17933223 [0,1,0,0,1,0|2,0,0]=4 581 B16R2.71 Nc1ccncc1OCc2ccccc2 Amb25184191 [0,1,0,0,1,0|1,0,0]=3 582 B16R2.71 Nc1cnccc1NCc2ccccc2 Amb7767649 [0,1,0,0,1,0|2,0,0]=4 583 B16R2.71 Nc1cnccc1OCc2ccccc2 Amb7765080 [0,1,0,0,1,0|1,0,0]=3 584 B16R2.71 Nc1cncnc1OCc2ccccc2 Amb23558035 [0,1,0,0,1,0|2,0,0]=4 585 B16R2.71 Nc1ncccc1NCc2ccccc2 Amb15701551 [0,1,0,0,1,0|2,0,0]=4 586 B16R2.71 Nc1ncccc1OCc2ccccc2 Amb2719821 [0,1,0,0,1,0|1,0,0]=3 587 B16R2.71 Nc1ncccc1OCc2ccccn2 Amb9208366 [0,1,0,0,1,0|2,0,0]=4 588 B16R2.71 Nc1ncccc1OCc2cccnc2 Amb9208365 [0,1,0,0,1,0|2,0,0]=4 589 B16R2.71 Nc1ncccc1OCc2ccncc2 Amb9208356 [0,1,0,0,1,0|2,0,0]=4 590 B16R2.71 Nc1nccnc1OCc2ccccc2 Amb10601931 [0,1,0,0,1,0|2,0,0]=4 591 B16R2.71 O=C1C=CC=CN1CCc2ccccc2 Amb33330037 [0,1,0,0,1,0|1,0,0]=3 592 B16R2.71 O=C1C=CC=CN1OCc2ccccc2 Amb21994776 [0,1,0,0,1,0|1,0,0]=3 593 B16R2.71 O=C1C=CN=CN1OCc2ccccc2 Amb27968077 [0,1,0,0,1,0|2,0,0]=4 594 B16R2.71 O=C1C=COC=C1OCc2ccccc2 Amb21962788 [0,1,0,0,1,0|1,0,0]=3 595 B16R2.71 O=C1NC=CC=C1OCc2ccccc2 Amb18537465 [0,1,0,0,1,0|1,0,0]=3 596 B16R2.71 O=c1ccocc1OCc2ccccc2 Amb22270207 [0,1,0,0,1,0|1,0,0]=3 597 B16R2.71 Oc1ccccc1CCc2ccccc2 Amb17843033 [0,1,0,0,1,0|0,0,0]=2 598 B16R2.71 Oc1ccccc1CNc2ccccc2 Amb2720827 [0,1,0,0,1,0|1,0,0]=3 599 B16R2.71 Oc1ccccc1CNc2ccccn2 Amb33276251 [0,1,0,0,1,0|2,0,0]=4 600 B16R2.71 Oc1ccccc1CNc2cccnc2 Amb2692216 [0,1,0,0,1,0|2,0,0]=4 601 B16R2.71 Oc1ccccc1NCc2ccccc2 Amb1076536 [0,1,0,0,1,0|1,0,0]=3 602 B16R2.71 Oc1ccccc1NCc2ccccn2 Amb22901094 [0,1,0,0,1,0|2,0,0]=4 603 B16R2.71 Oc1ccccc1OCc2ccccc2 Amb2583282 [0,1,0,0,1,0|0,0,0]=2 604 B16R2.71 Oc1ccccc1\C=C\c2ccccc2 Amb17920449 [0,1,0,0,1,0|0,0,2]=4 605 B16R2.71 Oc1ccccc1\C=N\c2ccccc2 Amb2386606 [0,1,0,0,1,0|1,0,1]=4 606 B16R2.71 Oc1ccccc1\N=N\c2ccccc2 Amb21812043 [0,1,0,0,1,0|2,0,0]=4 607 B16R2.71 Oc1cccnc1OCc2ccccc2 Amb2699423 [0,1,0,0,1,0|1,0,0]=3 608 B16R2.71 Oc1ccncc1OCc2ccccc2 Amb26457014 [0,1,0,0,1,0|1,0,0]=3 609 B16R2.71 Oc1cnccc1OCc2ccccc2 Amb25184181 [0,1,0,0,1,0|1,0,0]=3 610 B16R2.71 Oc1ncncc1OCc2ccccc2 Amb18653830 [0,1,0,0,1,0|2,0,0]=4 611 B16R2.71 Sc1ccccc1NCc2ccccc2 Amb27643633 [0,1,0,0,1,0|1,0,0]=3 612 B16R2.71 Sc1ccccc1OCc2ccccc2 Amb26321985 [0,1,0,0,1,0|0,0,0]=2 613 B16R2.71 [NH3+]c1ccccc1\C=C/c2ccccc2 Amb31302363 [0,1,0,0,1,0|0,0,2]=4 614 B16R2.71 [NH3+]c1ccccc1\C=C\c2ccccc2 Amb17777295 [0,1,0,0,1,0|0,0,2]=4 615 B16R2.71 [O-]c1ccccc1CNc2cccc[nH+]2 Amb4229463 [0,1,0,0,1,0|2,0,0]=4 616 B16R2.88 BrC(Cc1ccccc1)c2ccccc2 Amb9210661 [0,1,0,0,1,0|0,0,0]=2 617 B16R2.88 BrC(Cc1ccccc1)c2ccccn2 Amb29845392 [0,1,0,0,1,0|1,0,0]=3 618 B16R2.88 BrC(Cc1ccccc1)c2cccnc2 Amb29845394 [0,1,0,0,1,0|1,0,0]=3 619 B16R2.88 BrC(Cc1ccccc1)c2ccncc2 Amb29845396 [0,1,0,0,1,0|1,0,0]=3 620 B16R2.88 BrC(Cc1ccncc1)c2ccccc2 Amb28040756 [0,1,0,0,1,0|1,0,0]=3 621 B16R2.88 BrC(Cc1ccncn1)c2ccccc2 Amb35745445 [0,1,0,0,1,0|2,0,0]=4 622 B16R2.88 CC(Nc1ccccc1)c2ccccc2 Amb4017037 [0,1,0,0,1,0|1,0,0]=3 623 B16R2.88 CC(Nc1ccccc1)c2ccccn2 Amb534556 [0,1,0,0,1,0|2,0,0]=4 624 B16R2.88 CC(Nc1ccccc1)c2cccnc2 Amb9739106 [0,1,0,0,1,0|2,0,0]=4 625 B16R2.88 CC(Nc1ccccc1)c2ccncc2 Amb6356068 [0,1,0,0,1,0|2,0,0]=4 626 B16R2.88 CC(Nc1ccccn1)c2ccccc2 Amb6645085 [0,1,0,0,1,0|2,0,0]=4 627 B16R2.88 CN(Cc1ccccc1)c2ccccc2 Amb9787584 [0,1,0,0,1,0|1,0,0]=3 628 B16R2.88 CN(Cc1ccccc1)c2ccccn2 Amb17967451 [0,1,0,0,1,0|2,0,0]=4 629 B16R2.88 CN(Cc1ccccc1)c2cccnc2 Amb17967452 [0,1,0,0,1,0|2,0,0]=4 630 B16R2.88 C\C(=N/c1ccccc1)c2ccccc2 Amb17779517 [0,1,0,0,1,0|1,0,1]=4 631 B16R2.88 ClC(Cc1ccccc1)c2ccccc2 Amb9749535 [0,1,0,0,1,0|0,0,0]=2 632 B16R2.88 ClC(Cc1ccccn1)c2ccccc2 Amb27989133 [0,1,0,0,1,0|1,0,0]=3 633 B16R2.88 ClC(Cc1ccncc1)c2cccnc2 Amb27195491 [0,1,0,0,1,0|2,0,0]=4 634 B16R2.88 ClC(Cc1ccncc1)c2ccncc2 Amb27825185 [0,1,0,0,1,0|2,0,0]=4 635 B16R2.88 ClC(Cc1ccncn1)c2ccccc2 Amb35745446 [0,1,0,0,1,0|2,0,0]=4 636 B16R2.88 N=C(Nc1ccccc1)c2ccccc2 Amb1644481 [0,1,0,0,1,0|1,0,1]=4 637 B16R2.88 NC(Cc1ccccc1)c2ccccc2 Amb1657727 [0,1,0,0,1,0|0,0,0]=2 638 B16R2.88 NC(Cc1ccccc1)c2ccccc2 Amb3431767 [0,1,0,0,1,0|0,0,0]=2 639 B16R2.88 NC(Cc1ccccc1)c2ccccn2 Amb10610594 [0,1,0,0,1,0|1,0,0]=3 640 B16R2.88 NC(Cc1ccccc1)c2cccnc2 Amb18289054 [0,1,0,0,1,0|1,0,0]=3 641 B16R2.88 NC(Cc1ccccc1)c2ccncc2 Amb18289050 [0,1,0,0,1,0|1,0,0]=3 642 B16R2.88 NC(Cc1ccccc1)c2ncccn2 Amb18968310 [0,1,0,0,1,0|2,0,0]=4 643 B16R2.88 NC(Cc1ccccc1)c2ncccn2 Amb28750959 [0,1,0,0,1,0|2,0,0]=4 644 B16R2.88 NC(Cc1ccccn1)c2ccccc2 Amb32666135 [0,1,0,0,1,0|1,0,0]=3 645 B16R2.88 NC(Cc1ccccn1)c2ccccc2 Amb7772122 [0,1,0,0,1,0|1,0,0]=3 646 B16R2.88 NC(Cc1ccccn1)c2cccnc2 Amb33528629 [0,1,0,0,1,0|2,0,0]=4 647 B16R2.88 NN(Cc1ccccc1)c2ccccc2 Amb3620838 [0,1,0,0,1,0|1,0,0]=3 648 B16R2.88 NN(Cc1ccccc1)c2ccccc2 Amb4397512 [0,1,0,0,1,0|1,0,0]=3 649 B16R2.88 N[C@@H](Cc1ccccc1)c2ncccn2 Amb32716258 [0,1,0,0,1,0|2,0,0]=4 650 B16R2.88 N[C@@H](Cc1ccccn1)c2ccccc2 Amb26304416 [0,1,0,0,1,0|1,0,0]=3 651 B16R2.88 N[C@@H](Cc1ccccn1)c2ccccc2 Amb33140984 [0,1,0,0,1,0|1,0,0]=3 652 B16R2.88 N\C(=N\c1ccccc1)c2ccccc2 Amb3318637 [0,1,0,0,1,0|1,0,1]=4 653 B16R2.88 O=C(C[n+]1ccccc1)c2ccccc2 Amb2228102 [0,1,0,0,1,0|1,0,1]=4 654 B16R2.88 O=C(Cc1ccccc1)c2ccccc2 Amb1205838 [0,1,0,0,1,0|0,0,1]=3 655 B16R2.88 O=C(Cc1ccccc1)c2ccccn2 Amb10554500 [0,1,0,0,1,0|1,0,1]=4 656 B16R2.88 O=C(Cc1ccccc1)c2cccnc2 Amb5720532 [0,1,0,0,1,0|1,0,1]=4 657 B16R2.88 O=C(Cc1ccccc1)c2ccncc2 Amb33534977 [0,1,0,0,1,0|1,0,1]=4 658 B16R2.88 O=C(Cc1ccccn1)c2ccccc2 Amb33529218 [0,1,0,0,1,0|1,0,1]=4 659 B16R2.88 O=C(Cc1ccncc1)c2ccccc2 Amb33530368 [0,1,0,0,1,0|1,0,1]=4 660 B16R2.88 O=C(Nc1ccccc1)c2ccccc2 Amb6346347 [0,1,0,0,1,0|1,0,1]=4 661 B16R2.88 O=C(Oc1ccccc1)c2ccccc2 Amb2389283 [0,1,0,0,1,0|0,0,1]=3 662 B16R2.88 O=C(Oc1ccccc1)c2cccnc2 Amb4017594 [0,1,0,0,1,0|1,0,1]=4 663 B16R2.88 O=C(Oc1ccccc1)c2ccncc2 Amb4081020 [0,1,0,0,1,0|1,0,1]=4 664 B16R2.88 O=C(Oc1ccccn1)c2ccccc2 Amb2609898 [0,1,0,0,1,0|1,0,1]=4 665 B16R2.88 O=C(Oc1cccnc1)c2ccccc2 Amb2609761 [0,1,0,0,1,0|1,0,1]=4 666 B16R2.88 O=S(Cc1ccccc1)c2ccccc2 Amb2754572 [0,1,0,0,1,0|0,1,0]=3 667 B16R2.88 OC(C[n+]1ccccc1)c2ccccc2 Amb2613503 [0,1,0,0,1,0|1,0,0]=3 668 B16R2.88 OC(Cc1ccccc1)c2ccccc2 Amb9704347 [0,1,0,0,1,0|0,0,0]=2 669 B16R2.88 OC(Cc1ccccc1)c2ccccn2 Amb10567656 [0,1,0,0,1,0|1,0,0]=3 670 B16R2.88 OC(Cc1ccccc1)c2cccnc2 Amb17236934 [0,1,0,0,1,0|1,0,0]=3 671 B16R2.88 OC(Cc1ccccc1)c2ccncc2 Amb8439792 [0,1,0,0,1,0|1,0,0]=3 672 B16R2.88 OC(Cc1ccccn1)c2ccccc2 Amb10554546 [0,1,0,0,1,0|1,0,0]=3 673 B16R2.88 OC(Cc1cnccn1)c2ccccc2 Amb2691343 [0,1,0,0,1,0|2,0,0]=4 674 B16R2.88 ON(Cc1ccccc1)c2cccnc2 Amb27641916 [0,1,0,0,1,0|2,0,0]=4 675 B16R2.88 O[C@@H](Cc1ccccn1)c2ccccc2 Amb33249664 [0,1,0,0,1,0|1,0,0]=3 676 B16R2.88 S=C(Nc1ccccc1)c2ccccc2 Amb6337484 [0,1,0,0,1,0|1,0,1]=4 677 B16R2.88 SC(Cc1ccccc1)c2ccccc2 Amb7784738 [0,1,0,0,1,0|0,0,0]=2 678 B16R2.88 [NH2+]=C(Nc1ccccc1)c2ccccc2 Amb33513293 [0,1,0,0,1,0|1,0,1]=4 679 B16R2.88 [NH3+]C(Cc1ccccc1)c2ccccc2 Amb33513302 [0,1,0,0,1,0|0,0,0]=2 680 B16R2.88 [NH3+]N(Cc1ccccc1)c2ccccc2 Amb24113854 [0,1,0,0,1,0|1,0,0]=3 681 B16R2.132 Brc1ccc(C#Cc2ccccc2)cc1 Amb8447578 [0,1,0,0,1,0|0,0,2]=4 682 B16R2.132 Brc1ccc(CCc2ncccn2)cc1 Amb18230281 [0,1,0,0,1,0|2,0,0]=4 683 B16R2.132 Brc1ccc(CNc2ccccc2)cc1 Amb838971 [0,1,0,0,1,0|1,0,0]=3 684 B16R2.132 Brc1ccc(CNc2ccccn2)cc1 Amb3360975 [0,1,0,0,1,0|2,0,0]=4 685 B16R2.132 Brc1ccc(CNc2cccnc2)cc1 Amb6686461 [0,1,0,0,1,0|2,0,0]=4 686 B16R2.132 Brc1ccc(COc2ccccc2)cc1 Amb2710379 [0,1,0,0,1,0|0,0,0]=2 687 B16R2.132 Brc1ccc(COc2ccccc2)nc1 Amb28457102 [0,1,0,0,1,0|1,0,0]=3 688 B16R2.132 Brc1ccc(CSc2ccccc2)cc1 Amb22482416 [0,1,0,0,1,0|0,1,0]=3 689 B16R2.132 Brc1ccc(CSc2ccccc2)nc1 Amb27475623 [0,1,0,0,1,0|1,1,0]=4 690 B16R2.132 Brc1ccc(CSc2ccncc2)cc1 Amb27975232 [0,1,0,0,1,0|1,1,0]=4 691 B16R2.132 Brc1ccc(NCc2ccccc2)cc1 Amb33328969 [0,1,0,0,1,0|1,0,0]=3 692 B16R2.132 Brc1ccc(NCc2ccccc2)cc1 Amb839003 [0,1,0,0,1,0|1,0,0]=3 693 B16R2.132 Brc1ccc(NCc2ccccc2)nc1 Amb2618039 [0,1,0,0,1,0|2,0,0]=4 694 B16R2.132 Brc1ccc(NCc2ccccn2)cc1 Amb1897865 [0,1,0,0,1,0|2,0,0]=4 695 B16R2.132 Brc1ccc(NCc2cccnc2)cc1 Amb837638 [0,1,0,0,1,0|2,0,0]=4 696 B16R2.132 Brc1ccc(NCc2ccncc2)cc1 Amb837732 [0,1,0,0,1,0|2,0,0]=4 697 B16R2.132 Brc1ccc(OCc2ccccc2)cc1 Amb2447239 [0,1,0,0,1,0|0,0,0]=2 698 B16R2.132 Brc1ccc(OCc2ccccc2)cn1 Amb22498131 [0,1,0,0,1,0|1,0,0]=3 699 B16R2.132 Brc1ccc(OCc2ccccc2)nc1 Amb20241254 [0,1,0,0,1,0|1,0,0]=3 700 B16R2.132 Brc1ccc(OCc2ccccc2)nn1 Amb28125807 [0,1,0,0,1,0|2,0,0]=4 701 B16R2.132 Brc1ccc(OCc2cccnc2)cn1 Amb27414119 [0,1,0,0,1,0|2,0,0]=4 702 B16R2.132 Brc1ccc(OCc2cccnc2)nc1 Amb25113982 [0,1,0,0,1,0|2,0,0]=4 703 B16R2.132 Brc1ccc(OCc2ccncc2)cc1 Amb6270902 [0,1,0,0,1,0|1,0,0]=3 704 B16R2.132 Brc1ccc(OCc2cnccn2)cc1 Amb35700553 [0,1,0,0,1,0|2,0,0]=4 705 B16R2.132 Brc1ccc(SCc2ccccc2)cc1 Amb4012831 [0,1,0,0,1,0|0,1,0]=3 706 B16R2.132 Brc1ccc(SCc2ccccc2)nc1 Amb27610829 [0,1,0,0,1,0|1,1,0]=4 707 B16R2.132 Brc1ccc(\C=C\c2ccccc2)cc1 Amb4035121 [0,1,0,0,1,0|0,0,2]=4 708 B16R2.132 Brc1ccc(\N=C\c2ccccc2)cc1 Amb3725287 [0,1,0,0,1,0|1,0,1]=4 709 B16R2.132 Brc1ccc(\N=N\c2ccccc2)cc1 Amb21811992 [0,1,0,0,1,0|2,0,0]=4 710 B16R2.132 Brc1cnc(COc2ccccc2)nc1 Amb32420643 [0,1,0,0,1,0|2,0,0]=4 711 B16R2.132 Brc1cnc(OCc2ccccc2)cn1 Amb20670538 [0,1,0,0,1,0|2,0,0]=4 712 B16R2.132 Brc1cnc(OCc2ccccc2)nc1 Amb22047371 [0,1,0,0,1,0|2,0,0]=4 713 B16R2.132 C[n+]1ccc(OCc2ccccc2)cc1 Amb28204063 [0,1,0,0,1,0|1,0,0]=3 714 B16R2.132 Cc1ccc(C#Cc2ccccc2)cc1 Amb8392048 [0,1,0,0,1,0|0,0,2]=4 715 B16R2.132 Cc1ccc(CCc2ccccc2)cc1 Amb26640344 [0,1,0,0,1,0|0,0,0]=2 716 B16R2.132 Cc1ccc(CNc2ccccc2)cc1 Amb3725174 [0,1,0,0,1,0|1,0,0]=3 717 B16R2.132 Cc1ccc(CNc2ccccn2)cc1 Amb2577761 [0,1,0,0,1,0|2,0,0]=4 718 B16R2.132 Cc1ccc(CNc2cccnc2)cc1 Amb2762686 [0,1,0,0,1,0|2,0,0]=4 719 B16R2.132 Cc1ccc(NCc2ccccc2)cc1 Amb1651808 [0,1,0,0,1,0|1,0,0]=3 720 B16R2.132 Cc1ccc(NCc2ccccc2)cn1 Amb25089853 [0,1,0,0,1,0|2,0,0]=4 721 B16R2.132 Cc1ccc(NCc2ccccn2)cc1 Amb6700874 [0,1,0,0,1,0|2,0,0]=4 722 B16R2.132 Cc1ccc(NCc2cccnc2)cc1 Amb837787 [0,1,0,0,1,0|2,0,0]=4 723 B16R2.132 Cc1ccc(NCc2ccncc2)cc1 Amb837947 [0,1,0,0,1,0|2,0,0]=4 724 B16R2.132 Cc1ccc(OCc2ccccc2)cc1 Amb4018566 [0,1,0,0,1,0|0,0,0]=2 725 B16R2.132 Cc1ccc(OCc2ccccc2)cn1 Amb26873852 [0,1,0,0,1,0|1,0,0]=3 726 B16R2.132 Cc1ccc(OCc2ccccc2)nn1 Amb22488645 [0,1,0,0,1,0|2,0,0]=4 727 B16R2.132 Cc1ccc(SCc2ccccc2)cn1 Amb32924644 [0,1,0,0,1,0|1,1,0]=4 728 B16R2.132 Cc1ccc(\C=C\c2ccccc2)cc1 Amb24323238 [0,1,0,0,1,0|0,0,2]=4 729 B16R2.132 Cc1ncc(OCc2ccccc2)cn1 Amb23412495 [0,1,0,0,1,0|2,0,0]=4 730 B16R2.132 Clc1ccc(C#Cc2ccccc2)cc1 Amb10554672 [0,1,0,0,1,0|0,0,2]=4 731 B16R2.132 Clc1ccc(CNc2ccccc2)cc1 Amb839008 [0,1,0,0,1,0|1,0,0]=3 732 B16R2.132 Clc1ccc(CNc2ccccn2)cc1 Amb1839885 [0,1,0,0,1,0|2,0,0]=4 733 B16R2.132 Clc1ccc(CNc2cccnc2)cc1 Amb22489636 [0,1,0,0,1,0|2,0,0]=4 734 B16R2.132 Clc1ccc(CNc2cccnc2)cc1 Amb2383001 [0,1,0,0,1,0|2,0,0]=4 735 B16R2.132 Clc1ccc(CNc2ccncc2)cc1 Amb22489637 [0,1,0,0,1,0|2,0,0]=4 736 B16R2.132 Clc1ccc(COc2ccccc2)cn1 Amb6247442 [0,1,0,0,1,0|1,0,0]=3 737 B16R2.132 Clc1ccc(COc2ccccn2)cc1 Amb10766366 [0,1,0,0,1,0|1,0,0]=3 738 B16R2.132 Clc1ccc(COc2ccccn2)cn1 Amb32670836 [0,1,0,0,1,0|2,0,0]=4 739 B16R2.132 Clc1ccc(CSc2ccccc2)cc1 Amb2610191 [0,1,0,0,1,0|0,1,0]=3 740 B16R2.132 Clc1ccc(CSc2ccccc2)cn1 Amb6675873 [0,1,0,0,1,0|1,1,0]=4 741 B16R2.132 Clc1ccc(NCc2ccccc2)cc1 Amb3765690 [0,1,0,0,1,0|1,0,0]=3 742 B16R2.132 Clc1ccc(NCc2ccccc2)cn1 Amb25831247 [0,1,0,0,1,0|2,0,0]=4 743 B16R2.132 Clc1ccc(NCc2ccccn2)cc1 Amb6695987 [0,1,0,0,1,0|2,0,0]=4 744 B16R2.132 Clc1ccc(NCc2cccnc2)cc1 Amb2222641 [0,1,0,0,1,0|2,0,0]=4 745 B16R2.132 Clc1ccc(NCc2ccncc2)cc1 Amb838090 [0,1,0,0,1,0|2,0,0]=4 746 B16R2.132 Clc1ccc(OCc2ccccc2)cc1 Amb2684651 [0,1,0,0,1,0|0,0,0]=2 747 B16R2.132 Clc1ccc(OCc2ccccc2)cn1 Amb22498130 [0,1,0,0,1,0|1,0,0]=3 748 B16R2.132 Clc1ccc(OCc2ccccc2)nc1 Amb24082317 [0,1,0,0,1,0|1,0,0]=3 749 B16R2.132 Clc1ccc(OCc2ccccc2)nn1 Amb6255403 [0,1,0,0,1,0|2,0,0]=4 750 B16R2.132 Clc1ccc(OCc2ccccn2)cn1 Amb27479742 [0,1,0,0,1,0|2,0,0]=4 751 B16R2.132 Clc1ccc(\C=C\c2ccccc2)cc1 Amb10568579 [0,1,0,0,1,0|0,0,2]=4 752 B16R2.132 Clc1ccc(\C=N\c2ccccc2)cc1 Amb2227970 [0,1,0,0,1,0|1,0,1]=4 753 B16R2.132 Clc1ccc(\N=N\c2ccccc2)cc1 Amb21811991 [0,1,0,0,1,0|2,0,0]=4 754 B16R2.132 Clc1ncc(OCc2ccccc2)cn1 Amb10602060 [0,1,0,0,1,0|2,0,0]=4 755 B16R2.132 Fc1ccc(CNc2ccccc2)cc1 Amb3725460 [0,1,0,0,1,0|1,0,0]=3 756 B16R2.132 Fc1ccc(CNc2ccccn2)cc1 Amb22489870 [0,1,0,0,1,0|2,0,0]=4 757 B16R2.132 Fc1ccc(CNc2ccccn2)cc1 Amb2382993 [0,1,0,0,1,0|2,0,0]=4 758 B16R2.132 Fc1ccc(COc2ncccn2)cc1 Amb33613125 [0,1,0,0,1,0|2,0,0]=4 759 B16R2.132 Fc1ccc(NCc2ccccc2)cc1 Amb3726374 [0,1,0,0,1,0|1,0,0]=3 760 B16R2.132 Fc1ccc(NCc2ccccc2)nc1 Amb18975390 [0,1,0,0,1,0|2,0,0]=4 761 B16R2.132 Fc1ccc(NCc2ccccn2)cc1 Amb6696824 [0,1,0,0,1,0|2,0,0]=4 762 B16R2.132 Fc1ccc(NCc2cccnc2)cc1 Amb6336198 [0,1,0,0,1,0|2,0,0]=4 763 B16R2.132 Fc1ccc(NCc2ccncc2)cc1 Amb6351906 [0,1,0,0,1,0|2,0,0]=4 764 B16R2.132 Fc1ccc(OCc2ccccc2)cc1 Amb2684652 [0,1,0,0,1,0|0,0,0]=2 765 B16R2.132 Fc1ccc(OCc2ccccc2)cn1 Amb27774067 [0,1,0,0,1,0|1,0,0]=3 766 B16R2.132 Fc1ccc(OCc2ccccc2)nc1 Amb19959570 [0,1,0,0,1,0|1,0,0]=3 767 B16R2.132 Fc1ccc(OCc2ccccn2)cn1 Amb28040697 [0,1,0,0,1,0|2,0,0]=4 768 B16R2.132 Fc1ccc(\C=N\c2ccccc2)cc1 Amb2227967 [0,1,0,0,1,0|1,0,1]=4 769 B16R2.132 Fc1ccc(\N=N\c2ccccc2)cc1 Amb2390018 [0,1,0,0,1,0|2,0,0]=4 770 B16R2.132 Ic1ccc(C#Cc2ccccc2)cc1 Amb34914086 [0,1,0,0,1,0|0,0,2]=4 771 B16R2.132 Ic1ccc(CSc2ccccn2)cc1 Amb28341089 [0,1,0,0,1,0|1,1,0]=4 772 B16R2.132 Ic1ccc(CSc2ccncc2)cc1 Amb28076032 [0,1,0,0,1,0|1,1,0]=4 773 B16R2.132 Ic1ccc(NCc2ccccc2)cc1 Amb7760853 [0,1,0,0,1,0|1,0,0]=3 774 B16R2.132 Ic1ccc(NCc2ccccn2)cc1 Amb9208146 [0,1,0,0,1,0|2,0,0]=4 775 B16R2.132 Ic1ccc(NCc2cccnc2)cc1 Amb9204453 [0,1,0,0,1,0|2,0,0]=4 776 B16R2.132 Ic1ccc(NCc2ccncc2)cc1 Amb9203698 [0,1,0,0,1,0|2,0,0]=4 777 B16R2.132 Ic1ccc(OCc2ccccc2)cc1 Amb2684653 [0,1,0,0,1,0|0,0,0]=2 778 B16R2.132 Ic1ccc(OCc2ccccc2)cn1 Amb26380391 [0,1,0,0,1,0|1,0,0]=3 779 B16R2.132 Ic1ccc(OCc2ccccn2)cc1 Amb20627464 [0,1,0,0,1,0|1,0,0]=3 780 B16R2.132 Ic1ccc(OCc2cccnc2)cc1 Amb20626245 [0,1,0,0,1,0|1,0,0]=3 781 B16R2.132 Ic1ccc(OCc2ccncc2)cc1 Amb20627465 [0,1,0,0,1,0|1,0,0]=3 782 B16R2.132 Ic1ccc(OCc2cnccn2)cc1 Amb30018076 [0,1,0,0,1,0|2,0,0]=4 783 B16R2.132 Nc1ccc(C#Cc2ccccc2)cc1 Amb2416700 [0,1,0,0,1,0|0,0,2]=4 784 B16R2.132 Nc1ccc(CCc2ccccc2)cc1 Amb17101879 [0,1,0,0,1,0|0,0,0]=2 785 B16R2.132 Nc1ccc(CCc2ccccc2)cc1 Amb21954210 [0,1,0,0,1,0|0,0,0]=2 786 B16R2.132 Nc1ccc(CCc2ccccn2)cc1 Amb1102660 [0,1,0,0,1,0|1,0,0]=3 787 B16R2.132 Nc1ccc(CCc2ccccn2)cc1 Amb17622183 [0,1,0,0,1,0|1,0,0]=3 788 B16R2.132 Nc1ccc(CCc2ccncc2)cc1 Amb6335843 [0,1,0,0,1,0|1,0,0]=3 789 B16R2.132 Nc1ccc(CNc2ccccc2)cc1 Amb18972361 [0,1,0,0,1,0|1,0,0]=3 790 B16R2.132 Nc1ccc(CNc2ccccn2)cc1 Amb17100060 [0,1,0,0,1,0|2,0,0]=4 791 B16R2.132 Nc1ccc(COc2ccccc2)cc1 Amb1136463 [0,1,0,0,1,0|0,0,0]=2 792 B16R2.132 Nc1ccc(CSc2ccccc2)cc1 Amb2608452 [0,1,0,0,1,0|0,1,0]=3 793 B16R2.132 Nc1ccc(CSc2ccccn2)cc1 Amb6676759 [0,1,0,0,1,0|1,1,0]=4 794 B16R2.132 Nc1ccc(NCc2ccccc2)cc1 Amb4008914 [0,1,0,0,1,0|1,0,0]=3 795 B16R2.132 Nc1ccc(NCc2ccccc2)cc1 Amb836918 [0,1,0,0,1,0|1,0,0]=3 796 B16R2.132 Nc1ccc(NCc2ccccc2)cn1 Amb7767650 [0,1,0,0,1,0|2,0,0]=4 797 B16R2.132 Nc1ccc(NCc2ccccc2)nc1 Amb836910 [0,1,0,0,1,0|2,0,0]=4 798 B16R2.132 Nc1ccc(NCc2ccccn2)cc1 Amb9205291 [0,1,0,0,1,0|2,0,0]=4 799 B16R2.132 Nc1ccc(NCc2cccnc2)cc1 Amb7768123 [0,1,0,0,1,0|2,0,0]=4 800 B16R2.132 Nc1ccc(NCc2ccncc2)cc1 Amb9205306 [0,1,0,0,1,0|2,0,0]=4 801 B16R2.132 Nc1ccc(OCc2ccccc2)cc1 Amb22489506 [0,1,0,0,1,0|0,0,0]=2 802 B16R2.132 Nc1ccc(OCc2ccccc2)cc1 Amb2719847 [0,1,0,0,1,0|0,0,0]=2 803 B16R2.132 Nc1ccc(OCc2ccccc2)cc1 Amb6315574 [0,1,0,0,1,0|0,0,0]=2 804 B16R2.132 Nc1ccc(OCc2ccccc2)cn1 Amb30625649 [0,1,0,0,1,0|1,0,0]=3 805 B16R2.132 Nc1ccc(OCc2ccccc2)cn1 Amb6679789 [0,1,0,0,1,0|1,0,0]=3 806 B16R2.132 Nc1ccc(OCc2ccccc2)nc1 Amb1124881 [0,1,0,0,1,0|1,0,0]=3 807 B16R2.132 Nc1ccc(OCc2ccccn2)cc1 Amb1099016 [0,1,0,0,1,0|1,0,0]=3 808 B16R2.132 Nc1ccc(OCc2ccccn2)cc1 Amb22279532 [0,1,0,0,1,0|1,0,0]=3 809 B16R2.132 Nc1ccc(OCc2ccccn2)cn1 Amb31112291 [0,1,0,0,1,0|2,0,0]=4 810 B16R2.132 Nc1ccc(OCc2ccccn2)nc1 Amb31172507 [0,1,0,0,1,0|2,0,0]=4 811 B16R2.132 Nc1ccc(OCc2cccnc2)cc1 Amb1114707 [0,1,0,0,1,0|1,0,0]=3 812 B16R2.132 Nc1ccc(OCc2cccnc2)cc1 Amb24053231 [0,1,0,0,1,0|1,0,0]=3 813 B16R2.132 Nc1ccc(OCc2cccnc2)cn1 Amb31112292 [0,1,0,0,1,0|2,0,0]=4 814 B16R2.132 Nc1ccc(OCc2cccnc2)nc1 Amb31172508 [0,1,0,0,1,0|2,0,0]=4 815 B16R2.132 Nc1ccc(OCc2ccncc2)cc1 Amb1133349 [0,1,0,0,1,0|1,0,0]=3 816 B16R2.132 Nc1ccc(OCc2ccncc2)cn1 Amb31112293 [0,1,0,0,1,0|2,0,0]=4 817 B16R2.132 Nc1ccc(OCc2ccncc2)nc1 Amb31172509 [0,1,0,0,1,0|2,0,0]=4 818 B16R2.132 Nc1ccc(OCc2cnccn2)cc1 Amb17131789 [0,1,0,0,1,0|2,0,0]=4 819 B16R2.132 Nc1ccc(SCc2ccccc2)cc1 Amb6675929 [0,1,0,0,1,0|0,1,0]=3 820 B16R2.132 Nc1ccc(SCc2ccccc2)cn1 Amb6680021 [0,1,0,0,1,0|1,1,0]=4 821 B16R2.132 Nc1ccc(SCc2cccnc2)cc1 Amb86685 [0,1,0,0,1,0|1,1,0]=4 822 B16R2.132 Nc1ccc(\C=C\c2ccccc2)cc1 Amb33513281 [0,1,0,0,1,0|0,0,2]=4 823 B16R2.132 Nc1ccc(\N=N\c2ccccc2)cc1 Amb1348283 [0,1,0,0,1,0|2,0,0]=4 824 B16R2.132 Nc1cnc(CCc2ccccc2)nc1 Amb17486617 [0,1,0,0,1,0|2,0,0]=4 825 B16R2.132 Nc1cnc(COc2ccccc2)nc1 Amb17486585 [0,1,0,0,1,0|2,0,0]=4 826 B16R2.132 Nc1cnc(OCc2ccccc2)cn1 Amb27175185 [0,1,0,0,1,0|2,0,0]=4 827 B16R2.132 Nc1cnc(OCc2ccccc2)nc1 Amb18972705 [0,1,0,0,1,0|2,0,0]=4 828 B16R2.132 O=C1C=CC(NCc2ccccc2)=CN1 Amb27851180 [0,1,0,0,1,0|2,0,0]=4 829 B16R2.132 Oc1ccc(C#Cc2ccccc2)cc1 Amb10610495 [0,1,0,0,1,0|0,0,2]=4 830 B16R2.132 Oc1ccc(CNc2ccccc2)cc1 Amb10609692 [0,1,0,0,1,0|1,0,0]=3 831 B16R2.132 Oc1ccc(CNc2ccccc2)cc1 Amb3544585 [0,1,0,0,1,0|1,0,0]=3 832 B16R2.132 Oc1ccc(CNc2ccccn2)cc1 Amb15694898 [0,1,0,0,1,0|2,0,0]=4 833 B16R2.132 Oc1ccc(NCc2ccccc2)cc1 Amb837935 [0,1,0,0,1,0|1,0,0]=3 834 B16R2.132 Oc1ccc(OCc2ccccc2)cc1 Amb1228378 [0,1,0,0,1,0|0,0,0]=2 835 B16R2.132 Oc1ccc(OCc2ccccc2)nc1 Amb2699422 [0,1,0,0,1,0|1,0,0]=3 836 B16R2.132 Oc1ccc(OCc2cccnc2)cc1 Amb33528796 [0,1,0,0,1,0|1,0,0]=3 837 B16R2.132 Oc1ccc(OCc2ccncc2)cc1 Amb9210957 [0,1,0,0,1,0|1,0,0]=3 838 B16R2.132 Oc1ccc(SCc2ccccc2)cc1 Amb30594452 [0,1,0,0,1,0|0,1,0]=3 839 B16R2.132 Oc1ccc(\C=C\c2ccccc2)cc1 Amb6357380 [0,1,0,0,1,0|0,0,2]=4 840 B16R2.132 Oc1ccc(\N=C\c2ccccc2)cc1 Amb2778379 [0,1,0,0,1,0|1,0,1]=4 841 B16R2.132 Oc1ccc(\N=N\c2ccccc2)cc1 Amb8516757 [0,1,0,0,1,0|2,0,0]=4 842 B16R2.132 Sc1ccc(OCc2ccccc2)cc1 Amb27767077 [0,1,0,0,1,0|0,0,0]=2 843 B16R2.132 [NH3+]c1ccc(OCc2ccccc2)cc1 Amb24113829 [0,1,0,0,1,0|0,0,0]=2 844 B16R2.132 [O-][n+]1ccc(OCc2ccccc2)cc1 Amb2631918 [0,1,0,0,1,0|1,0,0]=3 845 B16R2.252 Brc1cc(NCc2ccccc2)ccn1 Amb27484913 [0,1,0,0,1,0|2,0,0]=4 846 B16R2.252 Brc1cc(OCc2ccccc2)ccn1 Amb23401282 [0,1,0,0,1,0|1,0,0]=3 847 B16R2.252 Brc1cccc(CCc2ncccn2)c1 Amb18230277 [0,1,0,0,1,0|2,0,0]=4 848 B16R2.252 Brc1cccc(CNc2ccccc2)c1 Amb838042 [0,1,0,0,1,0|1,0,0]=3 849 B16R2.252 Brc1cccc(CNc2ccccn2)c1 Amb17100055 [0,1,0,0,1,0|2,0,0]=4 850 B16R2.252 Brc1cccc(CNc2cccnc2)c1 Amb6686464 [0,1,0,0,1,0|2,0,0]=4 851 B16R2.252 Brc1cccc(COc2ccccc2)c1 Amb2724116 [0,1,0,0,1,0|0,0,0]=2 852 B16R2.252 Brc1cccc(CSc2ccccc2)c1 Amb5221073 [0,1,0,0,1,0|0,1,0]=3 853 B16R2.252 Brc1cccc(CSc2ccccc2)n1 Amb27196920 [0,1,0,0,1,0|1,1,0]=4 854 B16R2.252 Brc1cccc(NCc2ccccc2)c1 Amb838939 [0,1,0,0,1,0|1,0,0]=3 855 B16R2.252 Brc1cccc(NCc2ccccc2)n1 Amb19959441 [0,1,0,0,1,0|2,0,0]=4 856 B16R2.252 Brc1cccc(NCc2ccccn2)c1 Amb6696685 [0,1,0,0,1,0|2,0,0]=4 857 B16R2.252 Brc1cccc(NCc2cccnc2)c1 Amb6696594 [0,1,0,0,1,0|2,0,0]=4 858 B16R2.252 Brc1cccc(NCc2ccncc2)c1 Amb6696599 [0,1,0,0,1,0|2,0,0]=4 859 B16R2.252 Brc1cccc(OCc2ccccc2)c1 Amb2684648 [0,1,0,0,1,0|0,0,0]=2 860 B16R2.252 Brc1cccc(OCc2ccccc2)n1 Amb8388596 [0,1,0,0,1,0|1,0,0]=3 861 B16R2.252 Brc1cccc(OCc2ccccn2)c1 Amb6257056 [0,1,0,0,1,0|1,0,0]=3 862 B16R2.252 Brc1cccc(OCc2cccnc2)c1 Amb6272400 [0,1,0,0,1,0|1,0,0]=3 863 B16R2.252 Brc1cccc(OCc2cccnc2)n1 Amb27257120 [0,1,0,0,1,0|2,0,0]=4 864 B16R2.252 Brc1cccc(OCc2ccncc2)c1 Amb6260467 [0,1,0,0,1,0|1,0,0]=3 865 B16R2.252 Brc1cccc(OCc2cnccn2)c1 Amb35700554 [0,1,0,0,1,0|2,0,0]=4 866 B16R2.252 Brc1ccnc(NCc2ccccc2)c1 Amb19959554 [0,1,0,0,1,0|2,0,0]=4 867 B16R2.252 Brc1ccnc(OCc2ccccc2)c1 Amb19959540 [0,1,0,0,1,0|1,0,0]=3 868 B16R2.252 Brc1ccnc(OCc2ccccc2)n1 Amb25671334 [0,1,0,0,1,0|2,0,0]=4 869 B16R2.252 Brc1cncc(CNc2ccccc2)c1 Amb22276864 [0,1,0,0,1,0|2,0,0]=4 870 B16R2.252 Brc1cncc(NCc2ccccc2)c1 Amb24079791 [0,1,0,0,1,0|2,0,0]=4 871 B16R2.252 Brc1cncc(OCc2ccccc2)c1 Amb10067157 [0,1,0,0,1,0|1,0,0]=3 872 B16R2.252 Brc1cncc(SCc2ccccc2)c1 Amb28906204 [0,1,0,0,1,0|1,1,0]=4 873 B16R2.252 C[n+]1cccc(OCc2ccccc2)c1 Amb2609786 [0,1,0,0,1,0|1,0,0]=3 874 B16R2.252 Cc1cc(OCc2ccccc2)ccn1 Amb28291370 [0,1,0,0,1,0|1,0,0]=3 875 B16R2.252 Cc1cc(OCc2ccccc2)ncn1 Amb27436562 [0,1,0,0,1,0|2,0,0]=4 876 B16R2.252 Cc1cccc(CNc2ccccc2)c1 Amb4313246 [0,1,0,0,1,0|1,0,0]=3 877 B16R2.252 Cc1cccc(CNc2cccnc2)c1 Amb6686481 [0,1,0,0,1,0|2,0,0]=4 878 B16R2.252 Cc1cccc(NCc2ccccc2)c1 Amb419993 [0,1,0,0,1,0|1,0,0]=3 879 B16R2.252 Cc1cccc(NCc2ccccc2)c1 Amb6891897 [0,1,0,0,1,0|1,0,0]=3 880 B16R2.252 Cc1cccc(NCc2ccccc2)n1 Amb2221691 [0,1,0,0,1,0|2,0,0]=4 881 B16R2.252 Cc1cccc(NCc2ccccn2)c1 Amb6684530 [0,1,0,0,1,0|2,0,0]=4 882 B16R2.252 Cc1cccc(NCc2cccnc2)c1 Amb6684424 [0,1,0,0,1,0|2,0,0]=4 883 B16R2.252 Cc1cccc(NCc2ccncc2)c1 Amb6411080 [0,1,0,0,1,0|2,0,0]=4 884 B16R2.252 Cc1cccc(OCc2ccccc2)c1 Amb20622231 [0,1,0,0,1,0|0,0,0]=2 885 B16R2.252 Cc1cccc(OCc2ccccc2)n1 Amb26873289 [0,1,0,0,1,0|1,0,0]=3 886 B16R2.252 Cc1ccnc(NCc2ccccc2)c1 Amb3940048 [0,1,0,0,1,0|2,0,0]=4 887 B16R2.252 Cc1ccnc(OCc2ccccc2)c1 Amb25369515 [0,1,0,0,1,0|1,0,0]=3 888 B16R2.252 Cc1ccnc(OCc2ccccc2)n1 Amb24445301 [0,1,0,0,1,0|2,0,0]=4 889 B16R2.252 Cc1cncc(OCc2ccccc2)c1 Amb22043749 [0,1,0,0,1,0|1,0,0]=3 890 B16R2.252 Cc1cncc(OCc2ccccc2)n1 Amb28369936 [0,1,0,0,1,0|2,0,0]=4 891 B16R2.252 Cc1cncc(SCc2ccccc2)c1 Amb32405893 [0,1,0,0,1,0|1,1,0]=4 892 B16R2.252 Clc1cc(NCc2ccccc2)ccn1 Amb23673540 [0,1,0,0,1,0|2,0,0]=4 893 B16R2.252 Clc1cc(OCc2ccccc2)ccn1 Amb20623632 [0,1,0,0,1,0|1,0,0]=3 894 B16R2.252 Clc1cc(OCc2ccccc2)cnn1 Amb22276668 [0,1,0,0,1,0|2,0,0]=4 895 B16R2.252 Clc1cc(OCc2ccccc2)ncn1 Amb21929209 [0,1,0,0,1,0|2,0,0]=4 896 B16R2.252 Clc1cc(OCc2cccnc2)ccn1 Amb27868705 [0,1,0,0,1,0|2,0,0]=4 897 B16R2.252 Clc1cc(SCc2ccccc2)ccn1 Amb9154883 [0,1,0,0,1,0|1,1,0]=4 898 B16R2.252 Clc1cccc(CNc2ccccc2)c1 Amb4304160 [0,1,0,0,1,0|1,0,0]=3 899 B16R2.252 Clc1cccc(CNc2ccccn2)c1 Amb1761673 [0,1,0,0,1,0|2,0,0]=4 900 B16R2.252 Clc1cccc(CNc2cccnc2)c1 Amb2383002 [0,1,0,0,1,0|2,0,0]=4 901 B16R2.252 Clc1cccc(CNc2ccncc2)c1 Amb24093907 [0,1,0,0,1,0|2,0,0]=4 902 B16R2.252 Clc1cccc(NCc2ccccc2)c1 Amb33328994 [0,1,0,0,1,0|1,0,0]=3 903 B16R2.252 Clc1cccc(NCc2ccccc2)c1 Amb838903 [0,1,0,0,1,0|1,0,0]=3 904 B16R2.252 Clc1cccc(NCc2ccccn2)c1 Amb6695737 [0,1,0,0,1,0|2,0,0]=4 905 B16R2.252 Clc1cccc(NCc2cccnc2)c1 Amb6695669 [0,1,0,0,1,0|2,0,0]=4 906 B16R2.252 Clc1cccc(NCc2ccncc2)c1 Amb4419812 [0,1,0,0,1,0|2,0,0]=4 907 B16R2.252 Clc1cccc(OCc2ccccc2)c1 Amb2610190 [0,1,0,0,1,0|0,0,0]=2 908 B16R2.252 Clc1cccc(OCc2ccccc2)n1 Amb22432532 [0,1,0,0,1,0|1,0,0]=3 909 B16R2.252 Clc1cccc(OCc2ccncc2)n1 Amb16233291 [0,1,0,0,1,0|2,0,0]=4 910 B16R2.252 Clc1ccnc(CCc2ccccc2)n1 Amb27487923 [0,1,0,0,1,0|2,0,0]=4 911 B16R2.252 Clc1ccnc(NCc2ccccc2)c1 Amb27774226 [0,1,0,0,1,0|2,0,0]=4 912 B16R2.252 Clc1ccnc(OCc2ccccc2)c1 Amb22236357 [0,1,0,0,1,0|1,0,0]=3 913 B16R2.252 Clc1ccnc(OCc2ccccn2)c1 Amb22236276 [0,1,0,0,1,0|2,0,0]=4 914 B16R2.252 Clc1ccnc(OCc2cccnc2)c1 Amb22276248 [0,1,0,0,1,0|2,0,0]=4 915 B16R2.252 Clc1ccnc(OCc2ccncc2)c1 Amb22276417 [0,1,0,0,1,0|2,0,0]=4 916 B16R2.252 Clc1ccnc(SCc2ccccc2)c1 Amb22236362 [0,1,0,0,1,0|1,1,0]=4 917 B16R2.252 Clc1cncc(NCc2ccccc2)c1 Amb29864985 [0,1,0,0,1,0|2,0,0]=4 918 B16R2.252 Clc1cncc(OCc2ccccc2)n1 Amb503286 [0,1,0,0,1,0|2,0,0]=4 919 B16R2.252 Clc1nccc(OCc2ccccc2)n1 Amb20670068 [0,1,0,0,1,0|2,0,0]=4 920 B16R2.252 Fc1cc(OCc2ccccc2)ccn1 Amb22235139 [0,1,0,0,1,0|1,0,0]=3 921 B16R2.252 Fc1cc(SCc2ccccc2)ccn1 Amb27447085 [0,1,0,0,1,0|1,1,0]=4 922 B16R2.252 Fc1cccc(CNc2ccccc2)c1 Amb6685070 [0,1,0,0,1,0|1,0,0]=3 923 B16R2.252 Fc1cccc(CNc2ccccn2)c1 Amb7762026 [0,1,0,0,1,0|2,0,0]=4 924 B16R2.252 Fc1cccc(COc2ccccc2)c1 Amb2691208 [0,1,0,0,1,0|0,0,0]=2 925 B16R2.252 Fc1cccc(NCc2ccccc2)c1 Amb33328760 [0,1,0,0,1,0|1,0,0]=3 926 B16R2.252 Fc1cccc(NCc2ccccc2)c1 Amb6695891 [0,1,0,0,1,0|1,0,0]=3 927 B16R2.252 Fc1cccc(NCc2ccccc2)n1 Amb23606138 [0,1,0,0,1,0|2,0,0]=4 928 B16R2.252 Fc1cccc(NCc2ccccn2)c1 Amb6695901 [0,1,0,0,1,0|2,0,0]=4 929 B16R2.252 Fc1cccc(NCc2cccnc2)c1 Amb6695785 [0,1,0,0,1,0|2,0,0]=4 930 B16R2.252 Fc1cccc(NCc2ccncc2)c1 Amb6695790 [0,1,0,0,1,0|2,0,0]=4 931 B16R2.252 Fc1cccc(OCc2ccccc2)c1 Amb8392534 [0,1,0,0,1,0|0,0,0]=2 932 B16R2.252 Fc1cccc(SCc2ccccc2)n1 Amb27610813 [0,1,0,0,1,0|1,1,0]=4 933 B16R2.252 Fc1ccnc(CCc2ccccc2)n1 Amb35649263 [0,1,0,0,1,0|2,0,0]=4 934 B16R2.252 Fc1ccnc(COc2ccccc2)n1 Amb29883447 [0,1,0,0,1,0|2,0,0]=4 935 B16R2.252 Fc1cncc(OCc2ccccc2)c1 Amb27825548 [0,1,0,0,1,0|1,0,0]=3 936 B16R2.252 Fc1cncc(OCc2ccccc2)n1 Amb35708399 [0,1,0,0,1,0|2,0,0]=4 937 B16R2.252 Fc1nccc(OCc2ccccc2)n1 Amb35670899 [0,1,0,0,1,0|2,0,0]=4 938 B16R2.252 Ic1cccc(NCc2ccccc2)c1 Amb7761234 [0,1,0,0,1,0|1,0,0]=3 939 B16R2.252 Ic1cccc(NCc2ccccn2)c1 Amb9208170 [0,1,0,0,1,0|2,0,0]=4 940 B16R2.252 Ic1cccc(NCc2cccnc2)c1 Amb9204454 [0,1,0,0,1,0|2,0,0]=4 941 B16R2.252 Ic1cccc(NCc2ccncc2)c1 Amb9203727 [0,1,0,0,1,0|2,0,0]=4 942 B16R2.252 Ic1cccc(OCc2cccnc2)c1 Amb27861648 [0,1,0,0,1,0|1,0,0]=3 943 B16R2.252 Ic1cccc(OCc2cnccn2)c1 Amb30018074 [0,1,0,0,1,0|2,0,0]=4 944 B16R2.252 Ic1ccnc(OCc2ccccc2)c1 Amb22498332 [0,1,0,0,1,0|1,0,0]=3 945 B16R2.252 Ic1cncc(OCc2ccccc2)c1 Amb24329390 [0,1,0,0,1,0|1,0,0]=3 946 B16R2.252 Nc1cc(CCc2ccccc2)ccn1 Amb18652925 [0,1,0,0,1,0|1,0,0]=3 947 B16R2.252 Nc1cc(CCc2ccccc2)ccn1 Amb20622591 [0,1,0,0,1,0|1,0,0]=3 948 B16R2.252 Nc1cc(OCc2ccccc2)ccn1 Amb16233369 [0,1,0,0,1,0|1,0,0]=3 949 B16R2.252 Nc1cc(OCc2ccccc2)cnn1 Amb33521795 [0,1,0,0,1,0|2,0,0]=4 950 B16R2.252 Nc1cc(OCc2ccccc2)ncn1 Amb22642068 [0,1,0,0,1,0|2,0,0]=4 951 B16R2.252 Nc1cccc(C#Cc2ccccc2)c1 Amb1106348 [0,1,0,0,1,0|0,0,2]=4 952 B16R2.252 Nc1cccc(CCc2ccccn2)c1 Amb17762893 [0,1,0,0,1,0|1,0,0]=3 953 B16R2.252 Nc1cccc(CCc2ccncc2)c1 Amb6315608 [0,1,0,0,1,0|1,0,0]=3 954 B16R2.252 Nc1cccc(CCc2ncccn2)c1 Amb18864225 [0,1,0,0,1,0|2,0,0]=4 955 B16R2.252 Nc1cccc(COc2ccccc2)c1 Amb2724117 [0,1,0,0,1,0|0,0,0]=2 956 B16R2.252 Nc1cccc(COc2ccccc2)c1 Amb33164191 [0,1,0,0,1,0|0,0,0]=2 957 B16R2.252 Nc1cccc(COc2cccnc2)c1 Amb21965018 [0,1,0,0,1,0|1,0,0]=3 958 B16R2.252 Nc1cccc(CSc2ccccn2)c1 Amb6676721 [0,1,0,0,1,0|1,1,0]=4 959 B16R2.252 Nc1cccc(OCc2ccccc2)c1 Amb1119757 [0,1,0,0,1,0|0,0,0]=2 960 B16R2.252 Nc1cccc(OCc2ccccc2)n1 Amb26954004 [0,1,0,0,1,0|1,0,0]=3 961 B16R2.252 Nc1cccc(OCc2ccccn2)c1 Amb1119053 [0,1,0,0,1,0|1,0,0]=3 962 B16R2.252 Nc1cccc(OCc2ccccn2)c1 Amb6893101 [0,1,0,0,1,0|1,0,0]=3 963 B16R2.252 Nc1cccc(OCc2cccnc2)c1 Amb1116746 [0,1,0,0,1,0|1,0,0]=3 964 B16R2.252 Nc1cccc(OCc2ccncc2)c1 Amb1125338 [0,1,0,0,1,0|1,0,0]=3 965 B16R2.252 Nc1cccc(\C=C\c2ccccc2)c1 Amb18137668 [0,1,0,0,1,0|0,0,2]=4 966 B16R2.252 Nc1cccc(\N=N\c2ccccc2)c1 Amb17595232 [0,1,0,0,1,0|2,0,0]=4 967 B16R2.252 Nc1ccnc(COc2ccccc2)n1 Amb33531353 [0,1,0,0,1,0|2,0,0]=4 968 B16R2.252 Nc1ccnc(NCc2ccccc2)c1 Amb17337415 [0,1,0,0,1,0|2,0,0]=4 969 B16R2.252 Nc1ccnc(OCc2ccccc2)c1 Amb18981531 [0,1,0,0,1,0|1,0,0]=3 970 B16R2.252 Nc1ccnc(OCc2ccccc2)n1 Amb19957527 [0,1,0,0,1,0|2,0,0]=4 971 B16R2.252 Nc1ccnc(SCc2ccccc2)c1 Amb18981546 [0,1,0,0,1,0|1,1,0]=4 972 B16R2.252 Nc1cncc(OCc2ccccc2)c1 Amb21857185 [0,1,0,0,1,0|1,0,0]=3 973 B16R2.252 Nc1cncc(OCc2ccccc2)n1 Amb19664394 [0,1,0,0,1,0|2,0,0]=4 974 B16R2.252 Nc1nccc(OCc2ccccc2)n1 Amb27976554 [0,1,0,0,1,0|2,0,0]=4 975 B16R2.252 O=C1C=C(CCc2ccccc2)C=CN1 Amb35744393 [0,1,0,0,1,0|1,0,0]=3 976 B16R2.252 O=C1C=C(NCc2ccccc2)C=CN1 Amb22276456 [0,1,0,0,1,0|2,0,0]=4 977 B16R2.252 O=C1C=C(OCc2ccccc2)C=CN1 Amb19892336 [0,1,0,0,1,0|1,0,0]=3 978 B16R2.252 O=C1C=C(OCc2ccccc2)C=NN1 Amb22276670 [0,1,0,0,1,0|2,0,0]=4 979 B16R2.252 O=C1C=C(OCc2ccccc2)N=CN1 Amb27767107 [0,1,0,0,1,0|2,0,0]=4 980 B16R2.252 O=C1C=CC=C(OCc2ccccc2)N1 Amb27222379 [0,1,0,0,1,0|1,0,0]=3 981 B16R2.252 O=C1C=CN=C(CCc2ccccc2)N1 Amb19039013 [0,1,0,0,1,0|2,0,0]=4 982 B16R2.252 O=C1C=CNC(COc2ccccc2)=N1 Amb28751007 [0,1,0,0,1,0|2,0,0]=4 983 B16R2.252 O=C1CC(OCc2ccccc2)=CC=N1 Amb10607045 [0,1,0,0,1,0|1,0,1]=4 984 B16R2.252 Oc1cccc(CCc2ccccc2)c1 Amb8388641 [0,1,0,0,1,0|0,0,0]=2 985 B16R2.252 Oc1cccc(CNc2ccccc2)c1 Amb3546319 [0,1,0,0,1,0|1,0,0]=3 986 B16R2.252 Oc1cccc(CNc2ccccn2)c1 Amb17100057 [0,1,0,0,1,0|2,0,0]=4 987 B16R2.252 Oc1cccc(CNc2cccnc2)c1 Amb6686630 [0,1,0,0,1,0|2,0,0]=4 988 B16R2.252 Oc1cccc(COc2ccccc2)c1 Amb23443322 [0,1,0,0,1,0|0,0,0]=2 989 B16R2.252 Oc1cccc(NCc2ccccc2)c1 Amb6734931 [0,1,0,0,1,0|1,0,0]=3 990 B16R2.252 Oc1cccc(NCc2ccccc2)n1 Amb27767162 [0,1,0,0,1,0|2,0,0]=4 991 B16R2.252 Oc1cccc(OCc2ccccc2)c1 Amb33528500 [0,1,0,0,1,0|0,0,0]=2 992 B16R2.252 Oc1cccc(\C=C\c2ccccc2)c1 Amb6296671 [0,1,0,0,1,0|0,0,2]=4 993 B16R2.252 Oc1cccc(\N=N\c2ccccc2)c1 Amb21812045 [0,1,0,0,1,0|2,0,0]=4 994 B16R2.252 Oc1cncc(OCc2ccccc2)c1 Amb25903369 [0,1,0,0,1,0|1,0,0]=3 995 B16R2.252 Sc1cccc(OCc2ccccc2)c1 Amb22723410 [0,1,0,0,1,0|0,0,0]=2 996 B16R2.252 [O-][n+]1cccc(OCc2ccccc2)c1 Amb27169161 [0,1,0,0,1,0|1,0,0]=3 997 B16R2.135 Brc1ccc(CNCc2ccco2)cc1 Amb1114979 [0,1,0,0,1,0|2,0,0]=4 998 B16R2.135 Brc1ccc(CNCc2cccs2)cc1 Amb6729375 [0,1,0,0,1,0|2,0,0]=4 999 B16R2.135 Cc1ccc(CNCc2ccco2)cc1 Amb6335677 [0,1,0,0,1,0|2,0,0]=4 1000 B16R2.135 Cc1ccc(CNCc2cccs2)cc1 Amb838397 [0,1,0,0,1,0|2,0,0]=4 1001 B16R2.135 Clc1ccc(CNCc2ccco2)cc1 Amb6335663 [0,1,0,0,1,0|2,0,0]=4 1002 B16R2.135 Clc1ccc(CNCc2cccs2)cc1 Amb6737993 [0,1,0,0,1,0|2,0,0]=4 1003 B16R2.135 Clc1ccc(CNCc2ccsc2)cc1 Amb6737997 [0,1,0,0,1,0|2,0,0]=4 1004 B16R2.135 Fc1ccc(CNCc2ccco2)cc1 Amb6335671 [0,1,0,0,1,0|2,0,0]=4 1005 B16R2.135 Fc1ccc(CNCc2cccs2)cc1 Amb6351520 [0,1,0,0,1,0|2,0,0]=4 1006 B16R2.135 Nc1ccc(CSCc2ccco2)cc1 Amb9208234 [0,1,0,0,1,0|1,1,0]=4 1007 B16R2.135 Oc1ccc(CNCc2ccco2)cc1 Amb1120721 [0,1,0,0,1,0|2,0,0]=4 1008 B16R2.135 Oc1ccc(CNCc2cccs2)cc1 Amb6729374 [0,1,0,0,1,0|2,0,0]=4 1009 B16R2.255 Brc1cccc(CNCc2ccco2)c1 Amb1115639 [0,1,0,0,1,0|2,0,0]=4 1010 B16R2.255 Brc1cccc(CNCc2cccs2)c1 Amb6465240 [0,1,0,0,1,0|2,0,0]=4 1011 B16R2.255 Cc1cccc(CNCc2ccco2)c1 Amb6335676 [0,1,0,0,1,0|2,0,0]=4 1012 B16R2.255 Cc1cccc(CNCc2cccs2)c1 Amb15736442 [0,1,0,0,1,0|2,0,0]=4 1013 B16R2.255 Cc1cccc(CNCc2cccs2)c1 Amb6728544 [0,1,0,0,1,0|2,0,0]=4 1014 B16R2.255 Clc1cccc(CNCc2ccco2)c1 Amb1140540 [0,1,0,0,1,0|2,0,0]=4 1015 B16R2.255 Clc1cccc(CNCc2cccs2)c1 Amb1931472 [0,1,0,0,1,0|2,0,0]=4 1016 B16R2.255 Fc1cccc(CNCc2ccco2)c1 Amb6335680 [0,1,0,0,1,0|2,0,0]=4 1017 B16R2.255 Nc1cccc(COCc2ccco2)c1 Amb6244844 [0,1,0,0,1,0|1,0,0]=3 1018 B16R2.255 Oc1cccc(CNCc2ccco2)c1 Amb1135341 [0,1,0,0,1,0|2,0,0]=4 1019 B16R2.255 Oc1cccc(CNCc2cccs2)c1 Amb6729488 [0,1,0,0,1,0|2,0,0]=4 1020 B16R2.524 NC(Cc1ccccc1)Cc2ccco2 Amb5736019 [0,1,0,0,1,0|2,0,0]=4 1021 B16R2.524 NC(Cc1ccccc1)Cc2cccs2 Amb2237288 [0,1,0,0,1,0|2,0,0]=4 1022 B16R2.524 NC(Cc1ccccc1)Cn2cccc2 Amb5744328 [0,1,0,0,1,0|2,0,0]=4 1023 B16R2.2238 CC(NCc1ccccc1)c2ccco2 Amb2761643 [0,1,0,0,1,0|2,0,0]=4 1024 B16R2.2238 CC(NCc1ccccc1)c2cccs2 Amb6687392 [0,1,0,0,1,0|2,0,0]=4 1025 B16R2.2238 CC(NCc1ccccc1)c2ccoc2 Amb27865941 [0,1,0,0,1,0|2,0,0]=4 1026 B16R2.2238 CC(NCc1ccccc1)c2ccsc2 Amb19664365 [0,1,0,0,1,0|2,0,0]=4 1027 B16R2.2238 C[C@H](NCc1ccccc1)c2cccs2 Amb27475705 [0,1,0,0,1,0|2,0,0]=4 1028 B16R2.2238 NC(CCc1ccccc1)c2ccco2 Amb19028584 [0,1,0,0,1,0|2,0,0]=4 1029 B16R2.2238 NC(CCc1ccccc1)c2ccco2 Amb35746808 [0,1,0,0,1,0|2,0,0]=4 1030 B16R2.2238 NC(CCc1ccccc1)c2cccs2 Amb5736978 [0,1,0,0,1,0|2,0,0]=4 1031 B16R2.2238 O=C(OCc1ccccc1)c2ccco2 Amb22753188 [0,1,0,0,1,0|1,0,1]=4 1032 B16R2.2832 Cc1ccc(CNCc2ccccc2)o1 Amb27799683 [0,1,0,0,1,0|2,0,0]=4 1033 B16R2.2832 Cc1ccc(CNCc2ccccc2)s1 Amb6719939 [0,1,0,0,1,0|2,0,0]=4 1034 B16R2.2832 Cc1csc(COCc2ccccc2)n1 Amb27476360 [0,1,0,0,1,0|2,0,0]=4 1035 B16R2.2832 Clc1ccc(CNCc2ccccc2)s1 Amb6707703 [0,1,0,0,1,0|2,0,0]=4 1036 B16R2.2832 Clc1csc(CNCc2ccccc2)c1 Amb27607380 [0,1,0,0,1,0|2,0,0]=4 1037 B16R2.2832 Fc1ccc(CNCc2ccccc2)s1 Amb31210031 [0,1,0,0,1,0|2,0,0]=4 1038 B16R2.2832 Ic1cnn(COCc2ccccc2)c1 Amb27173611 [0,1,0,0,1,0|2,0,0]=4 1039 B16R2.2832 Nc1ccn(COCc2ccccc2)n1 Amb18654274 [0,1,0,0,1,0|2,0,0]=4 1040 B16R2.2832 Nc1cn(COCc2ccccc2)cn1 Amb33165638 [0,1,0,0,1,0|2,0,0]=4 1041 B16R2.2832 Nc1cnn(COCc2ccccc2)c1 Amb26047321 [0,1,0,0,1,0|2,0,0]=4 1042 B16R2.2832 Nc1csc(COCc2ccccc2)n1 Amb27955721 [0,1,0,0,1,0|2,0,0]=4 1043 B16R2.2832 Oc1csc(COCc2ccccc2)n1 Amb27862702 [0,1,0,0,1,0|2,0,0]=4 1044 B16R2.2959 Brc1ccccc1CNCc2cccs2 Amb6729500 [0,1,0,0,1,0|2,0,0]=4 1045 B16R2.2959 Brc1ccccc1CNCc2ccsc2 Amb33044526 [0,1,0,0,1,0|2,0,0]=4 1046 B16R2.2959 Cc1ccccc1CNCc2ccco2 Amb6335675 [0,1,0,0,1,0|2,0,0]=4 1047 B16R2.2959 Cc1ccccc1CNCc2cccs2 Amb1931474 [0,1,0,0,1,0|2,0,0]=4 1048 B16R2.2959 Clc1ccccc1CNCc2ccco2 Amb6335662 [0,1,0,0,1,0|2,0,0]=4 1049 B16R2.2959 Clc1ccccc1CNCc2ccco2 Amb8469712 [0,1,0,0,1,0|2,0,0]=4 1050 B16R2.2959 Clc1ccccc1CNCc2cccs2 Amb10825136 [0,1,0,0,1,0|2,0,0]=4 1051 B16R2.2959 Clc1ccccc1CNCc2cccs2 Amb1933832 [0,1,0,0,1,0|2,0,0]=4 1052 B16R2.2959 Fc1ccccc1CNCc2ccco2 Amb6335670 [0,1,0,0,1,0|2,0,0]=4 1053 B16R2.2959 Fc1ccccc1CNCc2ccco2 Amb6868093 [0,1,0,0,1,0|2,0,0]=4 1054 B16R2.2959 Fc1ccccc1CNCc2cccs2 Amb6455864 [0,1,0,0,1,0|2,0,0]=4 1055 B16R2.2959 Oc1ccccc1CNCc2ccco2 Amb2272474 [0,1,0,0,1,0|2,0,0]=4 1056 B16R2.2959 Oc1ccccc1CNCc2cccs2 Amb6729406 [0,1,0,0,1,0|2,0,0]=4 1057 B16R2.3250 Brc1cscc1CNCc2ccccc2 Amb24399033 [0,1,0,0,1,0|2,0,0]=4 1058 B16R2.3250 Cc1ccsc1CNCc2ccccc2 Amb6687360 [0,1,0,0,1,0|2,0,0]=4 1059 B16R2.3250 Cc1ccsc1CNCc2ccccc2 Amb6865682 [0,1,0,0,1,0|2,0,0]=4 1060 B16R2.3250 Cc1nccn1COCc2ccccc2 Amb26893505 [0,1,0,0,1,0|2,0,0]=4 1061 B16R2.3250 Cc1sccc1CNCc2ccccc2 Amb28047826 [0,1,0,0,1,0|2,0,0]=4 1062 B16R2.3250 Clc1ccsc1CNCc2ccccc2 Amb27488057 [0,1,0,0,1,0|2,0,0]=4 1063 B16R2.3250 Cn1cccc1CNCc2ccccc2 Amb6336194 [0,1,0,0,1,0|2,0,0]=4 1064 B16R2.3250 Fc1ccsc1CNCc2ccccc2 Amb27411075 [0,1,0,0,1,0|2,0,0]=4 1065 B16R2.3250 Nc1nccn1COCc2ccccc2 Amb33165779 [0,1,0,0,1,0|2,0,0]=4 1066 B16R2.5767 CC(NCc1ccco1)c2ccccc2 Amb1120443 [0,1,0,0,1,0|2,0,0]=4 1067 B16R2.5767 CC(NCc1cccs1)c2ccccc2 Amb837864 [0,1,0,0,1,0|2,0,0]=4 1068 B16R2.5767 C[C@@H](NCc1ccco1)c2ccccc2 Amb6853318 [0,1,0,0,1,0|2,0,0]=4 1069 B16R2.5767 NC(CCc1ccco1)c2ccccc2 Amb5737003 [0,1,0,0,1,0|2,0,0]=4 1070 B16R2.5767 NC(CCc1cccs1)c2ccccc2 Amb5737004 [0,1,0,0,1,0|2,0,0]=4 1071 B16R2.5767 O=C(OCc1ccco1)c2ccccc2 Amb2716287 [0,1,0,0,1,0|1,0,1]=4 1072 B18R2.270 Brc1ccc(CCOCc2ccccc2)cc1 Amb25322703 [0,1,0,0,0,1|0,0,0]=2 1073 B18R2.270 Cc1ccc(CNCCc2ccccc2)cc1 Amb6695457 [0,1,0,0,0,1|1,0,0]=3 1074 B18R2.270 Cc1ccc(CNOCc2ccccc2)cn1 Amb28041706 [0,1,0,0,0,1|1,0,0]=3 1075 B18R2.270 Clc1ccc(CCNCc2cccnc2)cc1 Amb1846009 [0,1,0,0,0,1|2,0,0]=4 1076 B18R2.270 Clc1ccc(CCNCc2ccncc2)cc1 Amb4132943 [0,1,0,0,0,1|2,0,0]=4 1077 B18R2.270 Clc1ccc(CNCCc2ccccc2)cc1 Amb6574449 [0,1,0,0,0,1|1,0,0]=3 1078 B18R2.270 Clc1ccc(COCCc2ccccn2)cn1 Amb9208805 [0,1,0,0,0,1|2,0,0]=4 1079 B18R2.270 Clc1ccc(NCCNc2ccccc2)cc1 Amb20139074 [0,1,0,0,0,1|2,0,0]=4 1080 B18R2.270 Clc1ccc(OCCNc2ccccc2)cc1 Amb4313629 [0,1,0,0,0,1|2,0,0]=4 1081 B18R2.270 Fc1ccc(CCNCc2ccccc2)cc1 Amb6689449 [0,1,0,0,0,1|1,0,0]=3 1082 B18R2.270 Fc1ccc(CCNCc2cccnc2)cc1 Amb6689376 [0,1,0,0,0,1|2,0,0]=4 1083 B18R2.270 Fc1ccc(CCNCc2ccncc2)cc1 Amb6689379 [0,1,0,0,0,1|2,0,0]=4 1084 B18R2.270 Fc1ccc(CNCCc2ccccc2)cc1 Amb1058734 [0,1,0,0,0,1|1,0,0]=3 1085 B18R2.270 Fc1ccc(CNCCc2ccccn2)cc1 Amb6694330 [0,1,0,0,0,1|2,0,0]=4 1086 B18R2.270 Fc1ccc(CNOCc2ccccc2)cc1 Amb27593642 [0,1,0,0,0,1|0,0,0]=2 1087 B18R2.270 Fc1ccc(SCCNc2ccccc2)cc1 Amb19148826 [0,1,0,0,0,1|2,0,0]=4 1088 B18R2.270 Nc1ccc(CCNCc2ccccn2)cc1 Amb18050952 [0,1,0,0,0,1|2,0,0]=4 1089 B18R2.270 Nc1ccc(CCNCc2cccnc2)cc1 Amb18050951 [0,1,0,0,0,1|2,0,0]=4 1090 B18R2.270 Nc1ccc(CCNCc2ccncc2)cc1 Amb18050949 [0,1,0,0,0,1|2,0,0]=4 1091 B18R2.270 Nc1ccc(CCOCc2ccccc2)cc1 Amb9380836 [0,1,0,0,0,1|0,0,0]=2 1092 B18R2.270 Nc1ccc(OCCCc2ccccc2)cc1 Amb2089061 [0,1,0,0,0,1|1,0,0]=3 1093 B18R2.270 Nc1ccc(OCCCc2ccccc2)nc1 Amb17093700 [0,1,0,0,0,1|2,0,0]=4 1094 B18R2.270 Nc1ccc(OCCOc2ccccc2)cc1 Amb6540692 [0,1,0,0,0,1|2,0,0]=4 1095 B18R2.270 Nc1ccc(OCCSc2ccccc2)cc1 Amb9027362 [0,1,0,0,0,1|2,0,0]=4 1096 B18R2.270 Oc1ccc(CNOCc2ccccc2)cc1 Amb28460962 [0,1,0,0,0,1|0,0,0]=2 1097 B18R2.270 Oc1ccc(CNOCc2ccccc2)nc1 Amb27244473 [0,1,0,0,0,1|1,0,0]=3 1098 B18R2.270 Oc1ccc(OC\C=C\c2ccccc2)cc1 Amb8837286 [0,1,0,0,0,1|1,0,1]=4 1099 B18R2.2429 CC(Cc1ccccc1)NCc2ccccc2 Amb17618657 [0,1,0,0,0,1|1,0,0]=3 1100 B18R2.2429 CC(Cc1ccccc1)NCc2ccccc2 Amb1813683 [0,1,0,0,0,1|1,0,0]=3 1101 B18R2.2429 C\C(Cc1ccccc1)=N/Nc2ccccc2 Amb11012847 [0,1,0,0,0,1|2,0,0]=4 1102 B18R2.2429 NC(CNc1ccccc1)Cc2ccccc2 Amb23927061 [0,1,0,0,0,1|1,0,0]=3 1103 B18R2.2429 N\C(Cc1ccccc1)=N\Cc2ccccc2 Amb23569056 [0,1,0,0,0,1|1,0,0]=3 1104 B18R2.2429 O=C(CCc1ccccc1)Cc2ccccc2 Amb10572893 [0,1,0,0,0,1|1,0,0]=3 1105 B18R2.2429 O=C(CCc1ccccc1)Nc2ccccc2 Amb6880289 [0,1,0,0,0,1|1,0,1]=4 1106 B18R2.2429 O=C(CNc1ccccc1)Nc2ccccc2 Amb269743 [0,1,0,0,0,1|2,0,0]=4 1107 B18R2.2429 O=C(CSc1ccccc1)Nc2ccccc2 Amb1223901 [0,1,0,0,0,1|2,0,0]=4 1108 B18R2.2429 O=C(Nc1ccccc1)OCc2ccccc2 Amb5290091 [0,1,0,0,0,1|0,0,1]=3 1109 B18R2.2429 O=C(OCc1ccccc1)Oc2ccccc2 Amb21963907 [0,1,0,0,0,1|0,0,1]=3 1110 B18R2.2429 S=C(Cc1ccccc1)NCc2ccccc2 Amb8459325 [0,1,0,0,0,1|1,0,0]=3 1111 B18R2.2429 S\C(=N/Cc1ccccc1)Nc2ccccc2 Amb8470269 [0,1,0,0,0,1|1,0,1]=4 1112 B18R2.2429 S\C(=N\c1ccccc1)NCc2ccccc2 Amb3467233 [0,1,0,0,0,1|1,0,1]=4 1113 B18R2.3984 Brc1ccccc1CNOCc2ccccc2 Amb27260825 [0,1,0,0,0,1|0,0,0]=2 1114 B18R2.3984 Brc1ccccc1OCOCc2ccccc2 Amb27251190 [0,1,0,0,0,1|0,0,0]=2 1115 B18R2.3984 Cc1ccccc1CCNCc2ccccn2 Amb23912366 [0,1,0,0,0,1|2,0,0]=4 1116 B18R2.3984 Cc1ccccc1CNCCc2ccccc2 Amb6695456 [0,1,0,0,0,1|1,0,0]=3 1117 B18R2.3984 Cc1cncnc1CNOCc2ccccc2 Amb27854233 [0,1,0,0,0,1|2,0,0]=4 1118 B18R2.3984 Cc1nccnc1CNOCc2ccccc2 Amb27484924 [0,1,0,0,0,1|2,0,0]=4 1119 B18R2.3984 Clc1ccccc1CNCCc2ccccc2 Amb6695451 [0,1,0,0,0,1|1,0,0]=3 1120 B18R2.3984 Clc1ccccc1CNOCc2ccccc2 Amb26487554 [0,1,0,0,0,1|0,0,0]=2 1121 B18R2.3984 Fc1ccccc1CCNCc2ccccc2 Amb6465186 [0,1,0,0,0,1|1,0,0]=3 1122 B18R2.3984 Fc1ccccc1CCNCc2cccnc2 Amb6693026 [0,1,0,0,0,1|2,0,0]=4 1123 B18R2.3984 Fc1ccccc1CCNCc2ccncc2 Amb6693030 [0,1,0,0,0,1|2,0,0]=4 1124 B18R2.3984 Fc1ccccc1CNCCc2ccccc2 Amb6695551 [0,1,0,0,0,1|1,0,0]=3 1125 B18R2.3984 Fc1ncccc1OCOCc2ccccc2 Amb27251849 [0,1,0,0,0,1|1,0,0]=3 1126 B18R2.3984 Ic1ccccc1CNCCc2ccccc2 Amb32410785 [0,1,0,0,0,1|1,0,0]=3 1127 B18R2.3984 Nc1ccccc1NCCCc2ccccc2 Amb19373177 [0,1,0,0,0,1|1,0,0]=3 1128 B18R2.3984 Nc1ccccc1NCCOc2ccccc2 Amb2226276 [0,1,0,0,0,1|2,0,0]=4 1129 B18R2.3984 Nc1ccccc1NC\C=C\c2ccccc2 Amb10070125 [0,1,0,0,0,1|1,0,1]=4 1130 B18R2.3984 Nc1ccccc1OCCCc2ccccc2 Amb2094487 [0,1,0,0,0,1|1,0,0]=3 1131 B18R2.3984 Nc1ccccc1OCCCc2ccccc2 Amb6660254 [0,1,0,0,0,1|1,0,0]=3 1132 B18R2.3984 Nc1ccccc1OCCOc2ccccc2 Amb2091067 [0,1,0,0,0,1|2,0,0]=4 1133 B18R2.3984 Nc1cccnc1OCCCc2ccccc2 Amb17093712 [0,1,0,0,0,1|2,0,0]=4 1134 B18R2.3984 Nc1ncccc1OCCCc2ccccc2 Amb7787265 [0,1,0,0,0,1|2,0,0]=4 1135 B18R2.3984 O=C1C=NC=CN1CCOCc2ccccc2 Amb27213090 [0,1,0,0,0,1|2,0,0]=4 1136 B18R2.3984 O=C1NC=CC=C1OCCCc2ccccc2 Amb18537476 [0,1,0,0,0,1|2,0,0]=4 1137 B18R2.6483 Cc1cc(CNOCc2ccccc2)ncn1 Amb28386494 [0,1,0,0,0,1|2,0,0]=4 1138 B18R2.6483 Cc1cccc(CCNCc2ccccc2)c1 Amb28283128 [0,1,0,0,0,1|1,0,0]=3 1139 B18R2.6483 Cc1cccc(CNCCc2ccccc2)c1 Amb4552917 [0,1,0,0,0,1|1,0,0]=3 1140 B18R2.6483 Cc1cccc(CNCCc2ccccc2)n1 Amb2693164 [0,1,0,0,0,1|2,0,0]=4 1141 B18R2.6483 Cc1cccc(CNOCc2ccccc2)c1 Amb25079434 [0,1,0,0,0,1|0,0,0]=2 1142 B18R2.6483 Cc1cccc(\C=N\OCc2ccccc2)n1 Amb6360361 [0,1,0,0,0,1|1,0,1]=4 1143 B18R2.6483 Clc1cccc(CNCCc2ccccc2)c1 Amb4303622 [0,1,0,0,0,1|1,0,0]=3 1144 B18R2.6483 Fc1cccc(CCNCc2ccccc2)c1 Amb9255562 [0,1,0,0,0,1|1,0,0]=3 1145 B18R2.6483 Fc1cccc(CCNCc2ccccn2)c1 Amb2231717 [0,1,0,0,0,1|2,0,0]=4 1146 B18R2.6483 Fc1cccc(CNCCc2ccccc2)c1 Amb6695455 [0,1,0,0,0,1|1,0,0]=3 1147 B18R2.6483 Fc1cccc(OCOCc2ccccc2)c1 Amb27593731 [0,1,0,0,0,1|0,0,0]=2 1148 B18R2.6483 Nc1cccc(CCNCc2ccccc2)c1 Amb18550386 [0,1,0,0,0,1|1,0,0]=3 1149 B18R2.6483 Nc1cccc(CCNCc2ccccn2)c1 Amb18550403 [0,1,0,0,0,1|2,0,0]=4 1150 B18R2.6483 Nc1cccc(CCNCc2cccnc2)c1 Amb18550402 [0,1,0,0,0,1|2,0,0]=4 1151 B18R2.6483 Nc1cccc(CCNCc2ccncc2)c1 Amb18050990 [0,1,0,0,0,1|2,0,0]=4 1152 B18R2.6483 Nc1cccc(COCCc2ccccc2)c1 Amb7790750 [0,1,0,0,0,1|0,0,0]=2 1153 B18R2.6483 Nc1cccc(OCCCc2ccccc2)c1 Amb2094488 [0,1,0,0,0,1|1,0,0]=3 1154 B18R2.6483 Nc1cccc(OCCCc2ccccc2)c1 Amb6251493 [0,1,0,0,0,1|1,0,0]=3 1155 B18R2.6483 Nc1cccc(OCCOc2ccccc2)c1 Amb2081954 [0,1,0,0,0,1|2,0,0]=4 1156 B18R2.6483 Nc1cccc(OCCSc2ccccc2)c1 Amb8868233 [0,1,0,0,0,1|2,0,0]=4 1157 B18R2.6483 Nc1ccnc(NCCCc2ccccc2)c1 Amb32419269 [0,1,0,0,0,1|2,0,0]=4 1158 B18R2.6483 Oc1cccc(OC\C=C\c2ccccc2)c1 Amb9211011 [0,1,0,0,0,1|1,0,1]=4 1159 B18R2.7189 CC(CNCc1ccccc1)c2ccccc2 Amb6651189 [0,1,0,0,0,1|1,0,0]=3 1160 B18R2.7189 CC(NCCc1ccccc1)c2ccccc2 Amb2612168 [0,1,0,0,0,1|1,0,0]=3 1161 B18R2.7189 CC(NOCc1ccccc1)c2cccnc2 Amb27944261 [0,1,0,0,0,1|1,0,0]=3 1162 B18R2.7189 CC(NOCc1ccccc1)c2ccncn2 Amb27778221 [0,1,0,0,0,1|2,0,0]=4 1163 B18R2.7189 CC(NOCc1ccccc1)c2cnccn2 Amb27455595 [0,1,0,0,0,1|2,0,0]=4 1164 B18R2.7189 NC(CCCc1ccccc1)c2ccccc2 Amb2371345 [0,1,0,0,0,1|1,0,0]=3 1165 B18R2.7189 NC(CCCc1ccccc1)c2ccccc2 Amb270381 [0,1,0,0,0,1|1,0,0]=3 1166 B18R2.7189 NC(CCSc1ccccc1)c2ccccc2 Amb29847198 [0,1,0,0,0,1|1,0,0]=3 1167 B18R2.7189 NC(CCSc1ccccn1)c2ccccc2 Amb29847204 [0,1,0,0,0,1|2,0,0]=4 1168 B18R2.7189 NC(CNCc1ccccc1)c2ccccc2 Amb27451476 [0,1,0,0,0,1|1,0,0]=3 1169 B18R2.7189 NC(COCc1ccccc1)c2ccccc2 Amb1126312 [0,1,0,0,0,1|0,0,0]=2 1170 B18R2.7189 NC(COCc1ccccc1)c2ccccc2 Amb19374866 [0,1,0,0,0,1|0,0,0]=2 1171 B18R2.7189 N\C(=N/OCc1ccccc1)c2ccccc2 Amb11212592 [0,1,0,0,0,1|0,0,1]=3 1172 B18R2.7189 O=C(CCCc1ccccc1)c2ccccc2 Amb1548163 [0,1,0,0,0,1|1,0,0]=3 1173 B18R2.7189 O=C(CCSc1ccccc1)c2ccccc2 Amb21984386 [0,1,0,0,0,1|1,0,1]=4 1174 B18R2.7189 O=C(COCc1ccccc1)c2cnccn2 Amb28386192 [0,1,0,0,0,1|2,0,0]=4 1175 B18R2.7189 O=C(NCCc1ccccc1)c2ccccc2 Amb6481313 [0,1,0,0,0,1|1,0,1]=4 1176 B18R2.7189 O=C(NOCc1ccccc1)c2cccnc2 Amb13970072 [0,1,0,0,0,1|1,0,1]=4 1177 B18R2.7189 O=C(OCCc1ccccc1)c2ccccc2 Amb4016539 [0,1,0,0,0,1|0,0,1]=3 1178 B18R2.7189 O=C(OCCc1ccccc1)c2cccnc2 Amb24081249 [0,1,0,0,0,1|1,0,1]=4 1179 B18R2.7189 OC(CCCc1ccccc1)c2ccccc2 Amb2385846 [0,1,0,0,0,1|1,0,0]=3 1180 B18R2.7189 OC(CCSc1ccccc1)c2ccccc2 Amb21984422 [0,1,0,0,0,1|1,0,0]=3 1181 B18R2.7189 OC(CCSc1ccccn1)c2ccccc2 Amb21984432 [0,1,0,0,0,1|2,0,0]=4 1182 B18R2.7189 OC(CNCc1ccccc1)c2ccccc2 Amb2726787 [0,1,0,0,0,1|1,0,0]=3 1183 B18R2.7189 OC(CNCc1ccccn1)c2ccccc2 Amb2282236 [0,1,0,0,0,1|2,0,0]=4 1184 B18R2.7189 OC(CNCc1cccnc1)c2ccccc2 Amb1091618 [0,1,0,0,0,1|2,0,0]=4 1185 B18R2.7189 OC(CNCc1ccncc1)c2ccccc2 Amb6352162 [0,1,0,0,0,1|2,0,0]=4 1186 B18R2.7189 O[C@H](CNCc1ccccc1)c2ccccc2 Amb6356900 [0,1,0,0,0,1|1,0,0]=3 1187 B18R2.199 CCN(Cc1ccccc1)Cc2ccccc2 Amb26599114 [0,2,0,0,0,0|1,0,0]=3 1188 B18R2.199 N#CN(Cc1ccccc1)Cc2ccccc2 Amb6384757 [0,2,0,0,0,0|1,0,0]=3 1189 B18R2.199 NCC(Cc1ccccc1)Cc2ccccc2 Amb33307138 [0,2,0,0,0,0|1,0,0]=3 1190 B18R2.199 NCC(Cc1ccccc1)Cc2ccccc2 Amb8950125 [0,2,0,0,0,0|1,0,0]=3 1191 B18R2.199 O=CC(Cc1ccccc1)Cc2ccccc2 Amb33172803 [0,2,0,0,0,0|1,0,0]=3 1192 B18R2.199 O=CN(Cc1ccccc1)Cc2ccccc2 Amb2696537 [0,2,0,0,0,0|1,0,0]=3 1193 B18R2.199 O=C\C(=C\c1ccccc1)Cc2ccccc2 Amb17596065 [0,2,0,0,0,0|1,0,1]=4 1194 B18R2.199 ON=C(Cc1ccccc1)Cc2ccccc2 Amb2575436 [0,2,0,0,0,0|1,0,0]=3 1195 B18R2.266 CN(Cc1ccccc1)Cc2ccc(F)cc2 Amb4552331 [0,2,0,0,0,0|1,0,0]=3 1196 B18R2.266 CN(Cc1ccccc1)Cc2ccc(I)cc2 Amb27473113 [0,2,0,0,0,0|1,0,0]=3 1197 B18R2.266 CN(Cc1ccccc1)Cc2ccc(N)cc2 Amb6246530 [0,2,0,0,0,0|1,0,0]=3 1198 B18R2.266 Cc1ccc(CC(=O)Cc2ccccc2)cc1 Amb17141934 [0,2,0,0,0,0|1,0,0]=3 1199 B18R2.266 Cc1ccc(CC(N)Cc2ccccc2)cc1 Amb5736072 [0,2,0,0,0,0|1,0,0]=3 1200 B18R2.266 Cc1ccc(OC(=O)Cc2ccccc2)cc1 Amb9787336 [0,2,0,0,0,0|2,0,0]=4 1201 B18R2.266 NC(Cc1ccccc1)Cc2ccc(Cl)cc2 Amb5736081 [0,2,0,0,0,0|1,0,0]=3 1202 B18R2.266 NC(Cc1ccccc1)Cc2ccc(F)cc2 Amb5736074 [0,2,0,0,0,0|1,0,0]=3 1203 B18R2.266 Nc1ccc(CC(=O)Nc2ccccc2)cc1 Amb1115851 [0,2,0,0,0,0|2,0,0]=4 1204 B18R2.266 Nc1ccc(NC(=O)Cc2ccccc2)cc1 Amb1812845 [0,2,0,0,0,0|2,0,0]=4 1205 B18R2.266 O=C(Cc1ccc(F)cc1)Nc2ccccc2 Amb277136 [0,2,0,0,0,0|2,0,0]=4 1206 B18R2.266 O=C(Cc1ccc(O)cc1)Nc2ccccc2 Amb8631745 [0,2,0,0,0,0|2,0,0]=4 1207 B18R2.266 O=C(Cc1ccccc1)Cc2ccc(Cl)cc2 Amb15693455 [0,2,0,0,0,0|1,0,0]=3 1208 B18R2.266 O=C(Cc1ccccc1)Cc2ccc(F)cc2 Amb17142412 [0,2,0,0,0,0|1,0,0]=3 1209 B18R2.266 O=C(Cc1ccccc1)Nc2ccc(Br)cc2 Amb1234441 [0,2,0,0,0,0|2,0,0]=4 1210 B18R2.266 O=C(Cc1ccccc1)Nc2ccc(Cl)cc2 Amb1235482 [0,2,0,0,0,0|2,0,0]=4 1211 B18R2.266 O=C(Cc1ccccc1)Nc2ccc(F)cc2 Amb6347214 [0,2,0,0,0,0|2,0,0]=4 1212 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2N Amb6245895 [0,2,0,0,0,0|1,0,0]=3 1213 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2O Amb8555912 [0,2,0,0,0,0|1,0,0]=3 1214 B18R2.3983 CN(Cc1ccccc1)Cc2cccnc2Cl Amb17626677 [0,2,0,0,0,0|2,0,0]=4 1215 B18R2.3983 Cc1ccccc1CC(=O)Cc2ccccc2 Amb17141935 [0,2,0,0,0,0|1,0,0]=3 1216 B18R2.3983 Cc1ccccc1CC(N)Cc2ccccc2 Amb5736070 [0,2,0,0,0,0|1,0,0]=3 1217 B18R2.3983 Cc1ccccc1CN(C)Cc2ccccc2 Amb13960745 [0,2,0,0,0,0|1,0,0]=3 1218 B18R2.3983 NC(Cc1ccccc1)Cc2ccccc2Cl Amb5736079 [0,2,0,0,0,0|1,0,0]=3 1219 B18R2.3983 NC(Cc1ccccc1)Cc2ccccc2F Amb5736073 [0,2,0,0,0,0|1,0,0]=3 1220 B18R2.3983 Nc1ccccc1CC(=O)Nc2ccccc2 Amb1115421 [0,2,0,0,0,0|2,0,0]=4 1221 B18R2.3983 Nc1ccccc1NC(=O)Cc2ccccc2 Amb6245124 [0,2,0,0,0,0|2,0,0]=4 1222 B18R2.3983 O=C(Cc1ccccc1)Cc2ccccc2Cl Amb17159694 [0,2,0,0,0,0|1,0,0]=3 1223 B18R2.3983 O=C(Cc1ccccc1)Cc2ccccc2F Amb17142413 [0,2,0,0,0,0|1,0,0]=3 1224 B18R2.3983 O=C(Cc1ccccc1)Nc2ccccc2F Amb6343045 [0,2,0,0,0,0|2,0,0]=4 1225 B18R2.6478 CN(Cc1ccccc1)Cc2cc(N)ccn2 Amb27427269 [0,2,0,0,0,0|2,0,0]=4 1226 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(Cl)n2 Amb27866211 [0,2,0,0,0,0|2,0,0]=4 1227 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(N)c2 Amb6248305 [0,2,0,0,0,0|1,0,0]=3 1228 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(N)n2 Amb27402207 [0,2,0,0,0,0|2,0,0]=4 1229 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(O)c2 Amb17511182 [0,2,0,0,0,0|1,0,0]=3 1230 B18R2.6478 Cc1cccc(CC(=O)Cc2ccccc2)c1 Amb17141936 [0,2,0,0,0,0|1,0,0]=3 1231 B18R2.6478 Cc1cccc(CC(=O)Cc2cccnc2)c1 Amb28728842 [0,2,0,0,0,0|2,0,0]=4 1232 B18R2.6478 Cc1cccc(CC(N)Cc2ccccc2)c1 Amb5736071 [0,2,0,0,0,0|1,0,0]=3 1233 B18R2.6478 Cc1cccc(CN(C)Cc2ccccc2)c1 Amb27443696 [0,2,0,0,0,0|1,0,0]=3 1234 B18R2.6478 Cc1cccc(CN(C)Cc2ccccc2)n1 Amb28193296 [0,2,0,0,0,0|2,0,0]=4 1235 B18R2.6478 Cc1cccc(OC(=O)Cc2ccccc2)c1 Amb22729560 [0,2,0,0,0,0|2,0,0]=4 1236 B18R2.6478 NC(Cc1ccccc1)Cc2cccc(Cl)c2 Amb5736080 [0,2,0,0,0,0|1,0,0]=3 1237 B18R2.6478 Nc1cccc(CC(=O)Nc2ccccc2)c1 Amb17048918 [0,2,0,0,0,0|2,0,0]=4 1238 B18R2.6478 Nc1cccc(CS(=O)Cc2ccccc2)c1 Amb19349570 [0,2,0,0,0,0|0,1,0]=3 1239 B18R2.6478 Nc1cccc(NC(=O)Cc2ccccc2)c1 Amb6543209 [0,2,0,0,0,0|2,0,0]=4 1240 B18R2.6478 O=C(Cc1cccc(Cl)c1)Nc2ccccc2 Amb1010472 [0,2,0,0,0,0|2,0,0]=4 1241 B18R2.6478 O=C(Cc1ccccc1)Cc2cccc(Cl)c2 Amb17159695 [0,2,0,0,0,0|1,0,0]=3 1242 B18R2.6478 O=C(Cc1ccccc1)Cc2cccc(F)c2 Amb17142414 [0,2,0,0,0,0|1,0,0]=3 1243 B18R2.6478 O=C(Cc1ccccc1)Nc2cccc(Br)c2 Amb6339486 [0,2,0,0,0,0|2,0,0]=4 1244 B18R2.6478 O=C(Cc1ccccc1)Nc2cccc(F)c2 Amb6561177 [0,2,0,0,0,0|2,0,0]=4 1245 B18R2.7204 CC(Oc1ccccc1)C(O)c2ccccc2 Amb30594712 [0,2,0,0,0,0|2,0,0]=4 1246 B18R2.7204 CN(Cc1ccccc1)C(=O)c2ccccc2 Amb3887385 [0,2,0,0,0,0|1,0,1]=4 1247 B18R2.7204 NC(C(=O)Cc1ccccc1)c2ccccc2 Amb35751044 [0,2,0,0,0,0|1,0,0]=3 1248 B18R2.7204 NC(C(=O)Cc1ccccc1)c2ccccc2 Amb35752560 [0,2,0,0,0,0|1,0,0]=3 1249 B18R2.7204 NC(C(=O)Nc1ccccc1)c2ccccc2 Amb10192744 [0,2,0,0,0,0|2,0,0]=4 1250 B18R2.7204 NC(C(=O)Nc1ccccc1)c2ccccc2 Amb6265241 [0,2,0,0,0,0|2,0,0]=4 1251 B18R2.7204 NC(Cc1ccccc1)C(O)c2ccccc2 Amb30326225 [0,2,0,0,0,0|1,0,0]=3 1252 B18R2.7204 NC(Cc1ccccc1)C(O)c2ccccc2 Amb8855253 [0,2,0,0,0,0|1,0,0]=3 1253 B18R2.7204 N[C@@H](C(=O)Nc1ccccc1)c2ccccc2 Amb18015035 [0,2,0,0,0,0|2,0,0]=4 1254 B18R2.7204 O=C(Cc1ccccc1)C(Br)c2ccccc2 Amb9732284 [0,2,0,0,0,0|1,0,0]=3 1255 B18R2.7204 O=C(Nc1ccccc1)C(Cl)c2ccccc2 Amb1229988 [0,2,0,0,0,0|2,0,0]=4 1256 B18R2.7204 O=C(Nc1ccccc1)C(O)c2ccccc2 Amb4012934 [0,2,0,0,0,0|2,0,0]=4 1257 B18R2.7204 O=C(c1ccccc1)N(O)Cc2ccccc2 Amb2616139 [0,2,0,0,0,0|1,0,1]=4 1258 B18R2.32233 C[N+](C)(Cc1ccccc1)Cc2ccccc2 Amb25930552 [0,2,0,0,0,0|1,0,0]=3 1259 B18R2.32233 C[N+](C)(Cc1ccccc1)Cc2ccccc2 Amb2701332 [0,2,0,0,0,0|1,0,0]=3 1260 B18R2.32233 O=S(=O)(Cc1ccccc1)Cc2ccccc2 Amb4018182 [0,2,0,0,0,0|0,1,0]=3 1261 B18R2.61 BrCc1cnc(COCc2ccccc2)nc1 Amb28206296 [0,2,0,0,0,0|2,0,0]=4 1262 B18R2.61 CCc1ccc(CNCc2ccccc2)cc1 Amb837968 [0,2,0,0,0,0|1,0,0]=3 1263 B18R2.61 CCc1ccc(CNCc2cccnc2)cc1 Amb6355611 [0,2,0,0,0,0|2,0,0]=4 1264 B18R2.61 CCc1ccc(CNCc2ccncc2)cc1 Amb6729572 [0,2,0,0,0,0|2,0,0]=4 1265 B18R2.61 CNc1ccc(COCc2ccccc2)cn1 Amb27625574 [0,2,0,0,0,0|1,0,0]=3 1266 B18R2.61 COc1ccc(CCOc2ccccc2)cc1 Amb33164065 [0,2,0,0,0,0|2,0,0]=4 1267 B18R2.61 COc1ccc(CNCc2ccccc2)cc1 Amb6355606 [0,2,0,0,0,0|1,0,0]=3 1268 B18R2.61 COc1ccc(CNCc2ccccn2)cc1 Amb22587913 [0,2,0,0,0,0|2,0,0]=4 1269 B18R2.61 COc1ccc(CNCc2ccccn2)cc1 Amb6355624 [0,2,0,0,0,0|2,0,0]=4 1270 B18R2.61 COc1ccc(CNCc2cccnc2)cc1 Amb6335709 [0,2,0,0,0,0|2,0,0]=4 1271 B18R2.61 COc1ccc(CNCc2ccncc2)cc1 Amb6355625 [0,2,0,0,0,0|2,0,0]=4 1272 B18R2.61 COc1ccc(C\N=C\c2ccccc2)cc1 Amb33743605 [0,2,0,0,0,0|1,0,1]=4 1273 B18R2.61 COc1ccc(NCCc2ccccc2)cc1 Amb6700986 [0,2,0,0,0,0|2,0,0]=4 1274 B18R2.61 COc1ccc(\C=N\Cc2ccccc2)cc1 Amb22641102 [0,2,0,0,0,0|1,0,1]=4 1275 B18R2.61 CSc1ccc(CNCc2ccccc2)cc1 Amb6719948 [0,2,0,0,0,0|1,0,0]=3 1276 B18R2.61 CSc1ccc(CNCc2ccccn2)cc1 Amb6721494 [0,2,0,0,0,0|2,0,0]=4 1277 B18R2.61 CSc1ccc(CNCc2cccnc2)cc1 Amb1838900 [0,2,0,0,0,0|2,0,0]=4 1278 B18R2.61 CSc1ccc(CNCc2ccncc2)cc1 Amb1923503 [0,2,0,0,0,0|2,0,0]=4 1279 B18R2.61 ClCc1ccc(CNCc2ccccc2)cc1 Amb27762433 [0,2,0,0,0,0|1,0,0]=3 1280 B18R2.61 N#Cc1ccc(CCOc2ccccc2)cc1 Amb17246080 [0,2,0,0,0,0|2,0,0]=4 1281 B18R2.61 N#Cc1ccc(COCc2ccccc2)cc1 Amb6274068 [0,2,0,0,0,0|0,0,0]=2 1282 B18R2.61 N#Cc1ccc(CSCc2ccccc2)cc1 Amb6677698 [0,2,0,0,0,0|0,1,0]=3 1283 B18R2.61 N#Cc1ccc(OCCc2ccccc2)cc1 Amb5769447 [0,2,0,0,0,0|2,0,0]=4 1284 B18R2.61 NCc1ccc(COCc2ccccc2)cc1 Amb1134104 [0,2,0,0,0,0|0,0,0]=2 1285 B18R2.61 NCc1ccc(OCCc2ccccc2)cc1 Amb17603139 [0,2,0,0,0,0|2,0,0]=4 1286 B18R2.61 O=Cc1ccc(OCCc2ccccc2)cc1 Amb5775614 [0,2,0,0,0,0|2,0,0]=4 1287 B18R2.253 CC(NCc1ccccc1)c2ccc(I)cc2 Amb9623118 [0,2,0,0,0,0|1,0,0]=3 1288 B18R2.253 CC(OCc1ccccc1)c2ccc(N)cc2 Amb20622769 [0,2,0,0,0,0|0,0,0]=2 1289 B18R2.253 C[C@@H](NCc1ccccc1)c2ccc(Cl)cc2 Amb27251420 [0,2,0,0,0,0|1,0,0]=3 1290 B18R2.253 C[C@@H](NCc1ccccc1)c2ccc(F)cc2 Amb28342739 [0,2,0,0,0,0|1,0,0]=3 1291 B18R2.253 C[C@H](NCc1ccccc1)c2ccc(F)cc2 Amb27602301 [0,2,0,0,0,0|1,0,0]=3 1292 B18R2.253 Cc1ccc(C(=O)CCc2ccccc2)cc1 Amb6303698 [0,2,0,0,0,0|1,0,1]=4 1293 B18R2.253 Cc1ccc(C(=O)OCc2ccccc2)cc1 Amb17883903 [0,2,0,0,0,0|0,0,1]=3 1294 B18R2.253 Cc1ccc(C(=O)OCc2ccccc2)cn1 Amb19895101 [0,2,0,0,0,0|1,0,1]=4 1295 B18R2.253 Cc1ccc(C(=S)NCc2ccccc2)cc1 Amb8456472 [0,2,0,0,0,0|1,0,1]=4 1296 B18R2.253 Cc1ccc(C(C)NCc2ccccc2)cc1 Amb2684682 [0,2,0,0,0,0|1,0,0]=3 1297 B18R2.253 Cc1ccc(C(C)NCc2cccnc2)cc1 Amb6729820 [0,2,0,0,0,0|2,0,0]=4 1298 B18R2.253 Cc1ccc(C(C)NCc2ccncc2)cc1 Amb6729606 [0,2,0,0,0,0|2,0,0]=4 1299 B18R2.253 Cc1ccc(C(N)CCc2ccccc2)cc1 Amb5737032 [0,2,0,0,0,0|1,0,0]=3 1300 B18R2.253 Cc1ccc(C(O)CNc2ccccc2)cc1 Amb17142326 [0,2,0,0,0,0|2,0,0]=4 1301 B18R2.253 Cc1ccc([C@@H](C)NCc2ccccc2)cc1 Amb27668772 [0,2,0,0,0,0|1,0,0]=3 1302 B18R2.253 NC(CCc1ccccc1)c2ccc(Cl)cc2 Amb5737215 [0,2,0,0,0,0|1,0,0]=3 1303 B18R2.253 NC(CCc1ccccc1)c2ccc(F)cc2 Amb5737188 [0,2,0,0,0,0|1,0,0]=3 1304 B18R2.253 NC(COc1ccccc1)c2ccc(Cl)cc2 Amb35788610 [0,2,0,0,0,0|2,0,0]=4 1305 B18R2.253 NC(COc1ccccc1)c2ccc(Cl)cc2 Amb35788879 [0,2,0,0,0,0|2,0,0]=4 1306 B18R2.253 NC(COc1ccccc1)c2ccc(F)cc2 Amb1132716 [0,2,0,0,0,0|2,0,0]=4 1307 B18R2.253 NC(COc1ccccc1)c2ccc(F)cc2 Amb35750103 [0,2,0,0,0,0|2,0,0]=4 1308 B18R2.253 Nc1ccc(C(=O)NCc2ccccc2)cc1 Amb6447197 [0,2,0,0,0,0|1,0,1]=4 1309 B18R2.253 Nc1ccc(C(=O)OCc2ccccc2)cc1 Amb31307726 [0,2,0,0,0,0|0,0,1]=3 1310 B18R2.253 Nc1ccc(C(=O)OCc2ccccc2)cc1 Amb3998358 [0,2,0,0,0,0|0,0,1]=3 1311 B18R2.253 Nc1ccc(C(=O)OCc2ccccc2)cn1 Amb19894700 [0,2,0,0,0,0|1,0,1]=4 1312 B18R2.253 Nc1ccc(S(=O)NCc2ccccc2)cc1 Amb18874474 [0,2,0,0,0,0|2,0,0]=4 1313 B18R2.253 O=C(CCc1ccccc1)c2ccc(Cl)cc2 Amb6303712 [0,2,0,0,0,0|1,0,1]=4 1314 B18R2.253 O=C(CCc1ccccc1)c2ccc(F)cc2 Amb6303714 [0,2,0,0,0,0|1,0,1]=4 1315 B18R2.253 O=C(CCc1ccccc1)c2ccc(O)cc2 Amb17596209 [0,2,0,0,0,0|1,0,1]=4 1316 B18R2.253 O=C(NCc1ccccc1)c2ccc(Br)cc2 Amb3097274 [0,2,0,0,0,0|1,0,1]=4 1317 B18R2.253 O=C(NCc1ccccc1)c2ccc(I)cc2 Amb1220012 [0,2,0,0,0,0|1,0,1]=4 1318 B18R2.253 O=C(NCc1ccccc1)c2ccc(O)cc2 Amb1233844 [0,2,0,0,0,0|1,0,1]=4 1319 B18R2.253 O=C(OCc1ccccc1)c2ccc(Br)cn2 Amb24333577 [0,2,0,0,0,0|1,0,1]=4 1320 B18R2.253 O=C(OCc1ccccc1)c2ccc(Cl)cc2 Amb3097381 [0,2,0,0,0,0|0,0,1]=3 1321 B18R2.253 O=C(OCc1ccccc1)c2ccc(Cl)nc2 Amb16207585 [0,2,0,0,0,0|1,0,1]=4 1322 B18R2.253 O=C(OCc1ccccc1)c2ccc(I)cc2 Amb4781966 [0,2,0,0,0,0|0,0,1]=3 1323 B18R2.253 O=C(OCc1ccccc1)c2ccc(O)cc2 Amb1229294 [0,2,0,0,0,0|0,0,1]=3 1324 B18R2.253 OC(CNc1ccccc1)c2ccc(Cl)cc2 Amb17160258 [0,2,0,0,0,0|2,0,0]=4 1325 B18R2.253 OC(CNc1ccccc1)c2ccc(F)cc2 Amb17142723 [0,2,0,0,0,0|2,0,0]=4 1326 B18R2.253 OC(COc1ccccc1)c2ccc(F)cc2 Amb23913990 [0,2,0,0,0,0|2,0,0]=4 1327 B18R2.253 OC(\C=C\c1ccccc1)c2ccc(Br)cc2 Amb24121368 [0,2,0,0,0,0|1,0,1]=4 1328 B18R2.253 OC(\C=C\c1ccccc1)c2ccc(Cl)cc2 Amb24121367 [0,2,0,0,0,0|1,0,1]=4 1329 B18R2.257 CC(CNc1ccc(O)cc1)c2ccccc2 Amb9608541 [0,2,0,0,0,0|2,0,0]=4 1330 B18R2.257 CC(NCc1ccc(Cl)cc1)c2ccccc2 Amb2786758 [0,2,0,0,0,0|1,0,0]=3 1331 B18R2.257 CC(NCc1ccc(F)cc1)c2ccccc2 Amb6537897 [0,2,0,0,0,0|1,0,0]=3 1332 B18R2.257 CC(NCc1ccc(F)cc1)c2ccccc2 Amb9732890 [0,2,0,0,0,0|1,0,0]=3 1333 B18R2.257 CC(NCc1ccc(O)cc1)c2ccccc2 Amb6684786 [0,2,0,0,0,0|1,0,0]=3 1334 B18R2.257 CC(SCc1ccc(N)cc1)c2ccccc2 Amb17498117 [0,2,0,0,0,0|0,1,0]=3 1335 B18R2.257 CN(CCc1ccc(N)cc1)c2ccccc2 Amb5733542 [0,2,0,0,0,0|2,0,0]=4 1336 B18R2.257 Cc1ccc(CCC(N)c2ccccc2)cc1 Amb5737008 [0,2,0,0,0,0|1,0,0]=3 1337 B18R2.257 Cc1ccc(CNC(C)c2ccccc2)cc1 Amb6335365 [0,2,0,0,0,0|1,0,0]=3 1338 B18R2.257 Cc1ccc(CNC(C)c2ccccc2)cc1 Amb9738291 [0,2,0,0,0,0|1,0,0]=3 1339 B18R2.257 Cc1ccc(NCC(O)c2ccccc2)cc1 Amb17142323 [0,2,0,0,0,0|2,0,0]=4 1340 B18R2.257 Cc1ccc(OCC(N)c2ccccc2)cc1 Amb6660231 [0,2,0,0,0,0|2,0,0]=4 1341 B18R2.257 Cc1ccc(SCC(N)c2ccccc2)cc1 Amb21988446 [0,2,0,0,0,0|2,0,0]=4 1342 B18R2.257 Cc1ccc(SCC(O)c2ccccc2)cc1 Amb21988443 [0,2,0,0,0,0|2,0,0]=4 1343 B18R2.257 NC(CCc1ccc(Cl)cc1)c2ccccc2 Amb5737017 [0,2,0,0,0,0|1,0,0]=3 1344 B18R2.257 NC(CCc1ccc(F)cc1)c2ccccc2 Amb35751860 [0,2,0,0,0,0|1,0,0]=3 1345 B18R2.257 NC(CCc1ccc(F)cc1)c2ccccc2 Amb5737010 [0,2,0,0,0,0|1,0,0]=3 1346 B18R2.257 NC(CSc1ccc(Cl)cc1)c2ccccc2 Amb21988445 [0,2,0,0,0,0|2,0,0]=4 1347 B18R2.257 Nc1ccc(CCC(O)c2ccccc2)cc1 Amb9781812 [0,2,0,0,0,0|1,0,0]=3 1348 B18R2.257 Nc1ccc(CNC(=O)c2ccccc2)cc1 Amb17142171 [0,2,0,0,0,0|1,0,1]=4 1349 B18R2.257 O=C1C=CC(=NOC(=O)c2ccccc2)C=C1 Amb900083 [0,2,0,0,0,0|1,0,1]=4 1350 B18R2.257 OC(CNc1ccc(Br)cc1)c2ccccc2 Amb15695374 [0,2,0,0,0,0|2,0,0]=4 1351 B18R2.257 OC(CNc1ccc(Cl)cc1)c2ccccc2 Amb17160255 [0,2,0,0,0,0|2,0,0]=4 1352 B18R2.257 OC(CNc1ccc(F)cc1)c2ccccc2 Amb17142720 [0,2,0,0,0,0|2,0,0]=4 1353 B18R2.257 OC(CSc1ccc(Cl)cc1)c2ccccc2 Amb21988444 [0,2,0,0,0,0|2,0,0]=4 1354 B18R2.269 Cc1ccc(CCCc2cccc(N)c2)cc1 Amb13953219 [0,2,0,0,0,0|1,0,0]=3 1355 B18R2.269 Cc1ccc(CCOc2cccc(N)c2)cc1 Amb17247785 [0,2,0,0,0,0|2,0,0]=4 1356 B18R2.269 Cc1ccc(CNCc2cccc(C)c2)cc1 Amb6699927 [0,2,0,0,0,0|1,0,0]=3 1357 B18R2.269 Cc1ccc(CNCc2cccc(Cl)c2)cc1 Amb5262655 [0,2,0,0,0,0|1,0,0]=3 1358 B18R2.269 Cc1ccc(CNCc2cccc(O)c2)cc1 Amb6700027 [0,2,0,0,0,0|1,0,0]=3 1359 B18R2.269 Cc1cccc(CCCc2ccc(N)cc2)c1 Amb13953215 [0,2,0,0,0,0|1,0,0]=3 1360 B18R2.269 Cc1cccc(CCOc2ccc(N)cc2)c1 Amb17247782 [0,2,0,0,0,0|2,0,0]=4 1361 B18R2.269 Cc1cccc(CNCc2ccc(Cl)cc2)c1 Amb6737984 [0,2,0,0,0,0|1,0,0]=3 1362 B18R2.269 Cc1cccc(CNCc2ccc(F)cc2)c1 Amb6697086 [0,2,0,0,0,0|1,0,0]=3 1363 B18R2.269 Cc1cccc(CNCc2ccc(O)cc2)c1 Amb6728519 [0,2,0,0,0,0|1,0,0]=3 1364 B18R2.269 Cc1cccc(OCCc2ccc(N)cc2)c1 Amb9380872 [0,2,0,0,0,0|2,0,0]=4 1365 B18R2.269 Clc1ccc(CCNc2cccc(Cl)c2)cc1 Amb18269943 [0,2,0,0,0,0|2,0,0]=4 1366 B18R2.269 Clc1ccc(CNCc2cccc(Cl)c2)cc1 Amb6625783 [0,2,0,0,0,0|1,0,0]=3 1367 B18R2.269 Clc1ccc(NCCc2cccc(Br)c2)cc1 Amb22754228 [0,2,0,0,0,0|2,0,0]=4 1368 B18R2.269 Clc1ccc(NCCc2cccc(Cl)c2)cc1 Amb22494584 [0,2,0,0,0,0|2,0,0]=4 1369 B18R2.269 Fc1ccc(CNCc2cccc(Br)c2)cc1 Amb6697075 [0,2,0,0,0,0|1,0,0]=3 1370 B18R2.269 Fc1ccc(CNCc2cccc(Cl)c2)cc1 Amb6697199 [0,2,0,0,0,0|1,0,0]=3 1371 B18R2.269 Fc1ccc(CNCc2cccc(F)c2)cc1 Amb6697082 [0,2,0,0,0,0|1,0,0]=3 1372 B18R2.269 Fc1ccc(NCCc2cccc(Br)c2)cc1 Amb22754235 [0,2,0,0,0,0|2,0,0]=4 1373 B18R2.269 Fc1ccc(NCCc2cccc(Cl)c2)cc1 Amb22754227 [0,2,0,0,0,0|2,0,0]=4 1374 B18R2.269 Fc1ccc(NCCc2cccc(F)c2)cc1 Amb22494583 [0,2,0,0,0,0|2,0,0]=4 1375 B18R2.269 Fc1cccc(CCNc2ccc(Cl)cc2)c1 Amb22754236 [0,2,0,0,0,0|2,0,0]=4 1376 B18R2.269 Fc1cccc(CNCc2ccc(Cl)cc2)c1 Amb6737982 [0,2,0,0,0,0|1,0,0]=3 1377 B18R2.269 Fc1cccc(NCCc2ccc(Cl)cc2)c1 Amb18269949 [0,2,0,0,0,0|2,0,0]=4 1378 B18R2.269 Nc1ccc(CCCc2cccc(F)c2)cc1 Amb13953213 [0,2,0,0,0,0|1,0,0]=3 1379 B18R2.269 Nc1ccc(CCCc2cccc(O)c2)cc1 Amb13953216 [0,2,0,0,0,0|1,0,0]=3 1380 B18R2.269 Nc1ccc(CCOc2cccc(Cl)c2)cc1 Amb9380878 [0,2,0,0,0,0|2,0,0]=4 1381 B18R2.269 Nc1ccc(CCOc2cccc(F)c2)cc1 Amb9380881 [0,2,0,0,0,0|2,0,0]=4 1382 B18R2.269 Nc1ccc(CSCc2cccc(Cl)c2)cc1 Amb17497843 [0,2,0,0,0,0|0,1,0]=3 1383 B18R2.269 Nc1ccc(CSCc2cccc(F)c2)cc1 Amb17498890 [0,2,0,0,0,0|0,1,0]=3 1384 B18R2.269 Nc1ccc(OCCc2cccc(Cl)c2)cc1 Amb17259636 [0,2,0,0,0,0|2,0,0]=4 1385 B18R2.269 Nc1cccc(CCCc2ccc(F)cc2)c1 Amb13953220 [0,2,0,0,0,0|1,0,0]=3 1386 B18R2.269 Nc1cccc(CCCc2ccc(O)cc2)c1 Amb13953218 [0,2,0,0,0,0|1,0,0]=3 1387 B18R2.269 Nc1cccc(OCCc2ccc(Cl)cc2)c1 Amb17259639 [0,2,0,0,0,0|2,0,0]=4 1388 B18R2.269 Nc1cccc(OCCc2ccc(F)cc2)c1 Amb17249417 [0,2,0,0,0,0|2,0,0]=4 1389 B18R2.269 Oc1cccc(CNCc2ccc(Cl)cc2)c1 Amb6738051 [0,2,0,0,0,0|1,0,0]=3 1390 B18R2.269 Oc1cccc(CNCc2ccc(F)cc2)c1 Amb6697202 [0,2,0,0,0,0|1,0,0]=3 1391 B18R2.274 Brc1ccc(\C=N\Cc2ccc(Br)cc2)cc1 Amb33719025 [0,2,0,0,0,0|1,0,1]=4 1392 B18R2.274 Cc1ccc(CCCc2ccc(N)cc2)cc1 Amb13953211 [0,2,0,0,0,0|1,0,0]=3 1393 B18R2.274 Cc1ccc(CCOc2ccc(N)cc2)cc1 Amb17247784 [0,2,0,0,0,0|2,0,0]=4 1394 B18R2.274 Cc1ccc(CNCc2ccc(C)cc2)cc1 Amb5262535 [0,2,0,0,0,0|1,0,0]=3 1395 B18R2.274 Cc1ccc(CNCc2ccc(Cl)cc2)cc1 Amb5262536 [0,2,0,0,0,0|1,0,0]=3 1396 B18R2.274 Cc1ccc(CNCc2ccc(F)cc2)cc1 Amb6456511 [0,2,0,0,0,0|1,0,0]=3 1397 B18R2.274 Cc1ccc(CNCc2ccc(O)cc2)cc1 Amb6699920 [0,2,0,0,0,0|1,0,0]=3 1398 B18R2.274 Cc1ccc(NCCc2ccc(Cl)cc2)cc1 Amb20077455 [0,2,0,0,0,0|2,0,0]=4 1399 B18R2.274 Cc1ccc(OCCc2ccc(N)cc2)cc1 Amb9380893 [0,2,0,0,0,0|2,0,0]=4 1400 B18R2.274 Clc1ccc(CNCc2ccc(Cl)cc2)cc1 Amb6645188 [0,2,0,0,0,0|1,0,0]=3 1401 B18R2.274 Fc1ccc(CNCc2ccc(Br)cc2)cc1 Amb6465241 [0,2,0,0,0,0|1,0,0]=3 1402 B18R2.274 Fc1ccc(CNCc2ccc(Cl)cc2)cc1 Amb6697072 [0,2,0,0,0,0|1,0,0]=3 1403 B18R2.274 Fc1ccc(CNCc2ccc(F)cc2)cc1 Amb6697074 [0,2,0,0,0,0|1,0,0]=3 1404 B18R2.274 Fc1ccc(NCCc2ccc(Cl)cc2)cc1 Amb18269951 [0,2,0,0,0,0|2,0,0]=4 1405 B18R2.274 Nc1ccc(CCCc2ccc(F)cc2)cc1 Amb13953212 [0,2,0,0,0,0|1,0,0]=3 1406 B18R2.274 Nc1ccc(CCCc2ccc(O)cc2)cc1 Amb13953210 [0,2,0,0,0,0|1,0,0]=3 1407 B18R2.274 Nc1ccc(CCOc2ccc(Cl)cc2)cc1 Amb9380867 [0,2,0,0,0,0|2,0,0]=4 1408 B18R2.274 Nc1ccc(CCOc2ccc(F)cc2)cc1 Amb9380874 [0,2,0,0,0,0|2,0,0]=4 1409 B18R2.274 Nc1ccc(CSCc2ccc(Cl)cc2)cc1 Amb17497789 [0,2,0,0,0,0|0,1,0]=3 1410 B18R2.274 Nc1ccc(CSCc2ccc(F)cc2)cc1 Amb17497823 [0,2,0,0,0,0|0,1,0]=3 1411 B18R2.274 Nc1ccc(CSCc2ccc(N)cc2)cc1 Amb6870974 [0,2,0,0,0,0|0,1,0]=3 1412 B18R2.274 Nc1ccc(OCCc2ccc(Cl)cc2)cc1 Amb17259638 [0,2,0,0,0,0|2,0,0]=4 1413 B18R2.274 Nc1ccc(OCCc2ccc(F)cc2)cc1 Amb17249416 [0,2,0,0,0,0|2,0,0]=4 1414 B18R2.274 Oc1ccc(CCCc2ccc(O)cc2)cc1 Amb17596273 [0,2,0,0,0,0|1,0,0]=3 1415 B18R2.274 Oc1ccc(CNCc2ccc(Cl)cc2)cc1 Amb6737972 [0,2,0,0,0,0|1,0,0]=3 1416 B18R2.274 Oc1ccc(CNCc2ccc(F)cc2)cc1 Amb6697071 [0,2,0,0,0,0|1,0,0]=3 1417 B18R2.274 Oc1ccc(CNCc2ccc(O)cc2)cc1 Amb17596288 [0,2,0,0,0,0|1,0,0]=3 1418 B18R2.4060 Brc1cnc(CNCc2ccccc2)c(Br)c1 Amb28318934 [0,2,0,0,0,0|2,0,0]=4 1419 B18R2.4060 CC1=NC(=O)N(COCc2ccccc2)C=C1 Amb27878188 [0,2,0,0,0,0|2,0,0]=4 1420 B18R2.4060 Cc1cc(N)ccc1OCCc2ccccc2 Amb8855943 [0,2,0,0,0,0|2,0,0]=4 1421 B18R2.4060 Cc1ccc(CNCc2ccccc2)c(Br)c1 Amb27666795 [0,2,0,0,0,0|1,0,0]=3 1422 B18R2.4060 Cc1ccc(CNCc2ccccc2)c(C)c1 Amb6687331 [0,2,0,0,0,0|1,0,0]=3 1423 B18R2.4060 Cc1ccc(OCCc2ccccc2)c(N)c1 Amb9002980 [0,2,0,0,0,0|2,0,0]=4 1424 B18R2.4060 Clc1cc(Br)ccc1CNCc2ccccc2 Amb27848195 [0,2,0,0,0,0|1,0,0]=3 1425 B18R2.4060 Clc1cc(Br)ccc1COCc2ccccc2 Amb28145591 [0,2,0,0,0,0|0,0,0]=2 1426 B18R2.4060 Clc1ccc(CNCc2ccccc2)c(Cl)c1 Amb6410518 [0,2,0,0,0,0|1,0,0]=3 1427 B18R2.4060 Clc1ccc(CNCc2ccccc2)c(Cl)c1 Amb6537907 [0,2,0,0,0,0|1,0,0]=3 1428 B18R2.4060 Clc1ccc(CNCc2ccccn2)c(Cl)c1 Amb781534 [0,2,0,0,0,0|2,0,0]=4 1429 B18R2.4060 Clc1ccc(CNCc2cccnc2)c(Cl)c1 Amb1846422 [0,2,0,0,0,0|2,0,0]=4 1430 B18R2.4060 Fc1cc(Br)ccc1CNCc2ccccn2 Amb10610077 [0,2,0,0,0,0|2,0,0]=4 1431 B18R2.4060 Fc1cc(Br)ccc1CNCc2ccccn2 Amb8867227 [0,2,0,0,0,0|2,0,0]=4 1432 B18R2.4060 Fc1ccc(CNCc2ccccc2)c(F)c1 Amb6687339 [0,2,0,0,0,0|1,0,0]=3 1433 B18R2.4060 Fc1ccc(CNCc2ccccc2)c(I)c1 Amb27794324 [0,2,0,0,0,0|1,0,0]=3 1434 B18R2.4060 Fc1ccc(NCCc2ccccc2)c(F)c1 Amb6698248 [0,2,0,0,0,0|2,0,0]=4 1435 B18R2.4060 NC1=NC(=O)NC=C1COCc2ccccc2 Amb22750219 [0,2,0,0,0,0|2,0,0]=4 1436 B18R2.4060 Nc1cc(Br)ccc1CNCc2ccccc2 Amb27391487 [0,2,0,0,0,0|1,0,0]=3 1437 B18R2.4060 Nc1cc(Br)ccc1OCCc2ccccc2 Amb7790209 [0,2,0,0,0,0|2,0,0]=4 1438 B18R2.4060 Nc1cc(Cl)ccc1OCCc2ccccc2 Amb6664156 [0,2,0,0,0,0|2,0,0]=4 1439 B18R2.4060 Nc1cc(F)ccc1NCCc2ccccc2 Amb845876 [0,2,0,0,0,0|2,0,0]=4 1440 B18R2.4060 Nc1ccc(NCCc2ccccc2)c(F)c1 Amb845928 [0,2,0,0,0,0|2,0,0]=4 1441 B18R2.4060 Nc1ccc(OCCc2ccccc2)c(Cl)c1 Amb1135078 [0,2,0,0,0,0|2,0,0]=4 1442 B18R2.4060 O=C1C=CN(COCc2ccccc2)C(=O)N1 Amb19703101 [0,2,0,0,0,0|2,0,0]=4 1443 B18R2.4060 Oc1ccc(CNCc2ccccc2)c(O)c1 Amb6687375 [0,2,0,0,0,0|1,0,0]=3 1444 B18R2.8976 CN1C=CC(CNCc2ccccc2)=CC1=O Amb27784797 [0,2,0,0,0,0|2,0,0]=4 1445 B18R2.8976 Cc1cc(CNCc2ccccc2)ccc1Br Amb27214500 [0,2,0,0,0,0|1,0,0]=3 1446 B18R2.8976 Cc1cc(CNCc2ccccc2)ccc1Cl Amb27815657 [0,2,0,0,0,0|1,0,0]=3 1447 B18R2.8976 Cc1cc(CNCc2ccccc2)ccc1F Amb17407245 [0,2,0,0,0,0|1,0,0]=3 1448 B18R2.8976 Cc1cc(OCCc2ccccc2)ccc1N Amb1116183 [0,2,0,0,0,0|2,0,0]=4 1449 B18R2.8976 Cc1ccc(CCCc2ccccc2)cc1N Amb13953226 [0,2,0,0,0,0|1,0,0]=3 1450 B18R2.8976 Cc1ccc(CNCc2ccccc2)cc1C Amb9218042 [0,2,0,0,0,0|1,0,0]=3 1451 B18R2.8976 Cc1ccc(CNCc2cccnc2)cc1F Amb21954090 [0,2,0,0,0,0|2,0,0]=4 1452 B18R2.8976 Cc1ccc(OCCc2ccccc2)cc1N Amb17142349 [0,2,0,0,0,0|2,0,0]=4 1453 B18R2.8976 Cc1cnc(COCc2ccccc2)nc1N Amb28137199 [0,2,0,0,0,0|2,0,0]=4 1454 B18R2.8976 Clc1ccc(CNCc2ccccc2)cc1Cl Amb6687340 [0,2,0,0,0,0|1,0,0]=3 1455 B18R2.8976 Clc1ccc(CNCc2ccccn2)cc1Cl Amb1923508 [0,2,0,0,0,0|2,0,0]=4 1456 B18R2.8976 Clc1ccc(CNCc2cccnc2)cc1Cl Amb1839519 [0,2,0,0,0,0|2,0,0]=4 1457 B18R2.8976 Fc1cc(CNCc2ccccc2)ccc1Br Amb27812296 [0,2,0,0,0,0|1,0,0]=3 1458 B18R2.8976 Fc1cc(CNCc2ccccc2)ccc1Cl Amb27797083 [0,2,0,0,0,0|1,0,0]=3 1459 B18R2.8976 Fc1ccc(CNCc2ccccc2)cc1Cl Amb28286636 [0,2,0,0,0,0|1,0,0]=3 1460 B18R2.8976 Fc1ccc(CNCc2ccccc2)cc1F Amb6687350 [0,2,0,0,0,0|1,0,0]=3 1461 B18R2.8976 Fc1ccc(NCCc2ccccc2)cc1Cl Amb7759969 [0,2,0,0,0,0|2,0,0]=4 1462 B18R2.8976 Fc1ccc(NCCc2ccccc2)cc1F Amb6694910 [0,2,0,0,0,0|2,0,0]=4 1463 B18R2.8976 NC1=CN(COCc2ccccc2)C=CC1=O Amb27240649 [0,2,0,0,0,0|1,0,0]=3 1464 B18R2.8976 Nc1cc(CNCc2ccccc2)ccc1Cl Amb27181657 [0,2,0,0,0,0|1,0,0]=3 1465 B18R2.8976 Nc1cc(OCCc2ccccc2)ccc1Cl Amb17160270 [0,2,0,0,0,0|2,0,0]=4 1466 B18R2.8976 Nc1ccc(CNCc2ccccc2)cc1I Amb27589583 [0,2,0,0,0,0|1,0,0]=3 1467 B18R2.8976 O=C1NC(COCc2ccccc2)=NC=C1I Amb27967024 [0,2,0,0,0,0|2,0,0]=4 1468 B18R2.8976 Oc1ccc(CNCc2ccccc2)cc1Br Amb28318117 [0,2,0,0,0,0|1,0,0]=3 1469 B18R2.8976 Oc1ccc(CNCc2ccccc2)cc1F Amb28046741 [0,2,0,0,0,0|1,0,0]=3 1470 B18R2.8976 S=C1NC(COCc2ccccc2)=NC=C1Br Amb28458599 [0,2,0,0,0,0|2,0,0]=4 1471 B18R2.9237 Cc1ccc(CCOc2ccccc2N)cc1 Amb17247797 [0,2,0,0,0,0|2,0,0]=4 1472 B18R2.9237 Cc1ccc(CNCc2ccccc2C)cc1 Amb5262660 [0,2,0,0,0,0|1,0,0]=3 1473 B18R2.9237 Cc1ccc(CNCc2ccccc2Cl)cc1 Amb6691721 [0,2,0,0,0,0|1,0,0]=3 1474 B18R2.9237 Cc1ccc(CNCc2ccccc2F)cc1 Amb5262659 [0,2,0,0,0,0|1,0,0]=3 1475 B18R2.9237 Cc1ccccc1CCCc2ccc(N)cc2 Amb13953217 [0,2,0,0,0,0|1,0,0]=3 1476 B18R2.9237 Cc1ccccc1CCOc2ccc(N)cc2 Amb17247779 [0,2,0,0,0,0|2,0,0]=4 1477 B18R2.9237 Cc1ccccc1CNCc2ccc(Cl)cc2 Amb59660 [0,2,0,0,0,0|1,0,0]=3 1478 B18R2.9237 Cc1ccccc1CNCc2ccc(F)cc2 Amb6697084 [0,2,0,0,0,0|1,0,0]=3 1479 B18R2.9237 Cc1ccccc1CNCc2ccc(O)cc2 Amb17142306 [0,2,0,0,0,0|1,0,0]=3 1480 B18R2.9237 Cc1ccccc1CSCc2ccc(N)cc2 Amb17497916 [0,2,0,0,0,0|0,1,0]=3 1481 B18R2.9237 Cc1ccccc1OCCc2ccc(N)cc2 Amb9380873 [0,2,0,0,0,0|2,0,0]=4 1482 B18R2.9237 Clc1ccc(CNCc2ccccc2Cl)cc1 Amb838223 [0,2,0,0,0,0|1,0,0]=3 1483 B18R2.9237 Fc1ccc(CNCc2ccccc2Cl)cc1 Amb837799 [0,2,0,0,0,0|1,0,0]=3 1484 B18R2.9237 Fc1ccc(CNCc2ccccc2F)cc1 Amb6697206 [0,2,0,0,0,0|1,0,0]=3 1485 B18R2.9237 Fc1ccccc1CNCc2ccc(Cl)cc2 Amb6697887 [0,2,0,0,0,0|1,0,0]=3 1486 B18R2.9237 Nc1ccc(CCCc2ccccc2F)cc1 Amb13953214 [0,2,0,0,0,0|1,0,0]=3 1487 B18R2.9237 Nc1ccc(CCOc2ccccc2Cl)cc1 Amb9380866 [0,2,0,0,0,0|2,0,0]=4 1488 B18R2.9237 Nc1ccc(CCOc2ccccc2F)cc1 Amb9380864 [0,2,0,0,0,0|2,0,0]=4 1489 B18R2.9237 Nc1ccc(CSCc2ccccc2Cl)cc1 Amb17497802 [0,2,0,0,0,0|0,1,0]=3 1490 B18R2.9237 Nc1ccc(CSCc2ccccc2F)cc1 Amb17497897 [0,2,0,0,0,0|0,1,0]=3 1491 B18R2.9237 Nc1ccc(OCCc2ccccc2Cl)cc1 Amb17259634 [0,2,0,0,0,0|2,0,0]=4 1492 B18R2.9237 Nc1ccc(OCCc2ccccc2F)cc1 Amb17249414 [0,2,0,0,0,0|2,0,0]=4 1493 B18R2.9237 Nc1ccccc1OCCc2ccc(Cl)cc2 Amb17259642 [0,2,0,0,0,0|2,0,0]=4 1494 B18R2.9237 Nc1ccccc1OCCc2ccc(F)cc2 Amb17249422 [0,2,0,0,0,0|2,0,0]=4 1495 B18R2.9237 Oc1ccc(CNCc2ccccc2Cl)cc1 Amb6691710 [0,2,0,0,0,0|1,0,0]=3 1496 B18R2.9237 Oc1ccc(CNCc2ccccc2F)cc1 Amb6697883 [0,2,0,0,0,0|1,0,0]=3 1497 B18R2.3606 BrCC(OCc1ccccc1)c2ccccc2 Amb25324857 [0,2,0,0,0,0|0,0,0]=2 1498 B18R2.3606 ICC(OCc1ccccc1)c2ccccc2 Amb27803345 [0,2,0,0,0,0|0,0,0]=2 1499 B18R2.3606 N#CC(CCc1ccncc1)c2ccccc2 Amb17245662 [0,2,0,0,0,0|2,0,0]=4 1500 B18R2.3606 N#CC(NCc1ccccc1)c2ccccc2 Amb22269828 [0,2,0,0,0,0|1,0,0]=3 1501 B18R2.3606 N#CC(NCc1ccccc1)c2ccccc2 Amb4322894 [0,2,0,0,0,0|1,0,0]=3 1502 B18R2.3606 N#CC(NCc1ccccc1)c2ccccn2 Amb17043402 [0,2,0,0,0,0|2,0,0]=4 1503 B18R2.3606 N#CC(NCc1ccccc1)c2cccnc2 Amb17043453 [0,2,0,0,0,0|2,0,0]=4 1504 B18R2.3606 N#CC(NCc1ccccc1)c2ccncc2 Amb17043509 [0,2,0,0,0,0|2,0,0]=4 1505 B18R2.3606 N#CC(NCc1ccccn1)c2ccccc2 Amb17043569 [0,2,0,0,0,0|2,0,0]=4 1506 B18R2.3606 N#CC(NCc1cccnc1)c2ccccc2 Amb17043570 [0,2,0,0,0,0|2,0,0]=4 1507 B18R2.3606 N#CC(NCc1ccncc1)c2ccccc2 Amb17043571 [0,2,0,0,0,0|2,0,0]=4 1508 B18R2.3606 NCC(OCc1ccccc1)c2ccccc2 Amb27181746 [0,2,0,0,0,0|0,0,0]=2 1509 B18R2.3606 O=CC(OCc1ccccc1)c2ccccc2 Amb18659449 [0,2,0,0,0,0|0,0,0]=2 1510 B18R2.3606 OCC(NCc1ccccc1)c2ccccc2 Amb24065094 [0,2,0,0,0,0|1,0,0]=3 1511 B18R2.3606 OCC(NCc1ccccc1)c2cccnc2 Amb25810858 [0,2,0,0,0,0|2,0,0]=4 1512 B18R2.3606 OC[C@H](NCc1ccccc1)c2ccccc2 Amb3940054 [0,2,0,0,0,0|1,0,0]=3 1513 B18R2.3634 CC(CC(=O)c1ccccc1)c2ccccc2 Amb2637812 [0,2,0,0,0,0|1,0,1]=4 1514 B18R2.3634 CN(CC(Cl)c1ccccc1)c2ccccc2 Amb17546796 [0,2,0,0,0,0|2,0,0]=4 1515 B18R2.3634 CN(CC(O)c1ccccc1)c2ccccc2 Amb17142342 [0,2,0,0,0,0|2,0,0]=4 1516 B18R2.3634 CN(C[C@@H](N)c1ccccc1)c2ccccc2 Amb5782297 [0,2,0,0,0,0|2,0,0]=4 1517 B18R2.3634 C[C@@H](NC(=O)c1ccccc1)c2ccccc2 Amb17779318 [0,2,0,0,0,0|1,0,1]=4 1518 B18R2.3634 C[C@@H](N[C@H](C)c1ccccc1)c2ccccc2 Amb3941446 [0,2,0,0,0,0|1,0,0]=3 1519 B18R2.3634 C[C@H](N[C@@H](C)c1ccccc1)c2ccccc2 Amb3939813 [0,2,0,0,0,0|1,0,0]=3 1520 B18R2.3634 C[C@H](N[C@@H](C)c1ccccc1)c2ccccc2 Amb8515910 [0,2,0,0,0,0|1,0,0]=3 1521 B18R2.3634 O=C(OC(=O)c1ccccc1)c2ccccc2 Amb4158236 [0,2,0,0,0,0|0,0,2]=4 1522 B18R2.3634 O=[Se](O[Se](=O)c1ccccc1)c2ccccc2 Amb8514182 [0,2,0,0,0,0|2,0,0]=4 1523 B18R2.3990 CC(NCc1ccccc1Cl)c2ccccc2 Amb2786769 [0,2,0,0,0,0|1,0,0]=3 1524 B18R2.3990 CC(NCc1ccccc1Cl)c2ccccc2 Amb6335356 [0,2,0,0,0,0|1,0,0]=3 1525 B18R2.3990 CC(NCc1ccccc1F)c2ccccc2 Amb6684907 [0,2,0,0,0,0|1,0,0]=3 1526 B18R2.3990 CC(NCc1ccccc1O)c2ccccc2 Amb2279131 [0,2,0,0,0,0|1,0,0]=3 1527 B18R2.3990 CN(CCc1ccccc1N)c2ccccc2 Amb5733560 [0,2,0,0,0,0|2,0,0]=4 1528 B18R2.3990 Cc1ccccc1CCC(N)c2ccccc2 Amb5737006 [0,2,0,0,0,0|1,0,0]=3 1529 B18R2.3990 Cc1ccccc1CNC(=O)c2ccccc2 Amb2629446 [0,2,0,0,0,0|1,0,1]=4 1530 B18R2.3990 Cc1ccccc1CNC(C)c2ccccc2 Amb2786756 [0,2,0,0,0,0|1,0,0]=3 1531 B18R2.3990 Cc1ccccc1CNC(C)c2ccccc2 Amb6537909 [0,2,0,0,0,0|1,0,0]=3 1532 B18R2.3990 Cc1ccccc1CNC(C)c2cccnc2 Amb6726404 [0,2,0,0,0,0|2,0,0]=4 1533 B18R2.3990 Cc1ccccc1NCC(O)c2ccccc2 Amb4019474 [0,2,0,0,0,0|2,0,0]=4 1534 B18R2.3990 NC(CCc1ccccc1Cl)c2ccccc2 Amb5737015 [0,2,0,0,0,0|1,0,0]=3 1535 B18R2.3990 NC(CCc1ccccc1F)c2ccccc2 Amb5737009 [0,2,0,0,0,0|1,0,0]=3 1536 B18R2.3990 NC(COc1ccccc1Cl)c2ccccc2 Amb17110187 [0,2,0,0,0,0|2,0,0]=4 1537 B18R2.3990 NC(COc1ccccc1F)c2ccccc2 Amb1126350 [0,2,0,0,0,0|2,0,0]=4 1538 B18R2.3990 NC(COc1ccccc1F)c2ccccc2 Amb33545131 [0,2,0,0,0,0|2,0,0]=4 1539 B18R2.3990 Nc1ccccc1SCC(O)c2ccccc2 Amb13951682 [0,2,0,0,0,0|2,0,0]=4 1540 B18R2.3990 O=C(CCc1ccccc1Cl)c2ccccc2 Amb9031545 [0,2,0,0,0,0|1,0,1]=4 1541 B18R2.3990 OC(CNc1ccccc1Cl)c2ccccc2 Amb17160253 [0,2,0,0,0,0|2,0,0]=4 1542 B18R2.3990 OC(CNc1ccccc1F)c2ccccc2 Amb17142719 [0,2,0,0,0,0|2,0,0]=4 1543 B18R2.3990 Oc1ccccc1OCC(O)c2ccccc2 Amb10608 [0,2,0,0,0,0|2,0,0]=4 1544 B18R2.4001 CC(NCc1ccccc1)c2ccccc2Cl Amb2684627 [0,2,0,0,0,0|1,0,0]=3 1545 B18R2.4001 CC(NCc1ccccc1)c2ccccc2O Amb31291089 [0,2,0,0,0,0|1,0,0]=3 1546 B18R2.4001 CC(NCc1cccnc1)c2ccccc2N Amb9901131 [0,2,0,0,0,0|2,0,0]=4 1547 B18R2.4001 C[C@@H](NCc1ccccc1)c2ccccc2F Amb28325019 [0,2,0,0,0,0|1,0,0]=3 1548 B18R2.4001 C\C(=N/Cc1ccccc1)c2ccccc2O Amb2774213 [0,2,0,0,0,0|1,0,1]=4 1549 B18R2.4001 C\C(=N\Cc1ccccc1)c2ccccc2N Amb27810357 [0,2,0,0,0,0|1,0,1]=4 1550 B18R2.4001 C\C(=N\Cc1ccccc1)c2ccccc2O Amb26898728 [0,2,0,0,0,0|1,0,1]=4 1551 B18R2.4001 Cc1ccccc1C(=O)CCc2ccccc2 Amb6303696 [0,2,0,0,0,0|1,0,1]=4 1552 B18R2.4001 Cc1ccccc1C(=O)NCc2ccccc2 Amb6349802 [0,2,0,0,0,0|1,0,1]=4 1553 B18R2.4001 Cc1ccccc1C(=O)OCc2ccccc2 Amb4845263 [0,2,0,0,0,0|0,0,1]=3 1554 B18R2.4001 Cc1ccccc1C(O)CNc2ccccc2 Amb17142324 [0,2,0,0,0,0|2,0,0]=4 1555 B18R2.4001 Nc1ccccc1C(=O)NCc2ccccc2 Amb6334950 [0,2,0,0,0,0|1,0,1]=4 1556 B18R2.4001 Nc1ccccc1C(=O)OCc2ccccc2 Amb2684622 [0,2,0,0,0,0|0,0,1]=3 1557 B18R2.4001 Nc1cnccc1C(=O)OCc2ccccc2 Amb27189844 [0,2,0,0,0,0|1,0,1]=4 1558 B18R2.4001 Nc1ncccc1C(=O)OCc2ccccc2 Amb24431847 [0,2,0,0,0,0|1,0,1]=4 1559 B18R2.4001 O=C(CCc1ccccc1)c2ccccc2Cl Amb6303724 [0,2,0,0,0,0|1,0,1]=4 1560 B18R2.4001 O=C(CCc1ccccc1)c2ccccc2F Amb6303725 [0,2,0,0,0,0|1,0,1]=4 1561 B18R2.4001 O=C(CCc1ccccc1)c2ccccc2O Amb3940305 [0,2,0,0,0,0|1,0,1]=4 1562 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2Br Amb6337854 [0,2,0,0,0,0|1,0,1]=4 1563 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2Cl Amb1233498 [0,2,0,0,0,0|1,0,1]=4 1564 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2I Amb1212359 [0,2,0,0,0,0|1,0,1]=4 1565 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2O Amb1208383 [0,2,0,0,0,0|1,0,1]=4 1566 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2S Amb27432062 [0,2,0,0,0,0|1,0,1]=4 1567 B18R2.4001 O=C(OCc1ccccc1)c2ccccc2F Amb4747960 [0,2,0,0,0,0|0,0,1]=3 1568 B18R2.4001 O=C(OCc1ccccc1)c2ccccc2O Amb3940600 [0,2,0,0,0,0|0,0,1]=3 1569 B18R2.4001 O=C(OCc1ccccc1)c2ccncc2F Amb13887028 [0,2,0,0,0,0|1,0,1]=4 1570 B18R2.4001 OC(CNc1ccccc1)c2ccccc2Cl Amb17160256 [0,2,0,0,0,0|2,0,0]=4 1571 B18R2.4001 OC(CNc1ccccc1)c2ccccc2F Amb17142722 [0,2,0,0,0,0|2,0,0]=4 1572 B18R2.6463 CC(NCc1ccccc1)c2cccc(O)c2 Amb6687424 [0,2,0,0,0,0|1,0,0]=3 1573 B18R2.6463 Cc1cccc(C(=O)CCc2ccccc2)c1 Amb6303697 [0,2,0,0,0,0|1,0,1]=4 1574 B18R2.6463 Cc1cccc(C(=O)OCc2ccccc2)c1 Amb2661473 [0,2,0,0,0,0|0,0,1]=3 1575 B18R2.6463 Cc1cccc(C(O)CNc2ccccc2)c1 Amb17142325 [0,2,0,0,0,0|2,0,0]=4 1576 B18R2.6463 NC(CCc1ccccc1)c2cccc(Cl)c2 Amb35753068 [0,2,0,0,0,0|1,0,0]=3 1577 B18R2.6463 NC(CCc1ccccc1)c2cccc(F)c2 Amb35751871 [0,2,0,0,0,0|1,0,0]=3 1578 B18R2.6463 NC(CCc1ccccc1)c2cccc(F)c2 Amb35753067 [0,2,0,0,0,0|1,0,0]=3 1579 B18R2.6463 Nc1cccc(C(=O)CCc2ccccc2)c1 Amb17343371 [0,2,0,0,0,0|1,0,1]=4 1580 B18R2.6463 Nc1cccc(C(=O)NCc2ccccc2)c1 Amb2693438 [0,2,0,0,0,0|1,0,1]=4 1581 B18R2.6463 Nc1cccc(C(=O)NCc2ccccc2)c1 Amb6546048 [0,2,0,0,0,0|1,0,1]=4 1582 B18R2.6463 Nc1cccc(C(=O)OCc2ccccc2)c1 Amb18539416 [0,2,0,0,0,0|0,0,1]=3 1583 B18R2.6463 Nc1cccc(C(O)CNc2ccccc2)c1 Amb18227730 [0,2,0,0,0,0|2,0,0]=4 1584 B18R2.6463 O=C(CCc1ccccc1)c2cccc(Cl)c2 Amb6303711 [0,2,0,0,0,0|1,0,1]=4 1585 B18R2.6463 O=C(NCc1ccccc1)c2cccc(Br)c2 Amb1234349 [0,2,0,0,0,0|1,0,1]=4 1586 B18R2.6463 O=C(NCc1ccccc1)c2cccc(Cl)c2 Amb6347597 [0,2,0,0,0,0|1,0,1]=4 1587 B18R2.6463 O=C(NCc1ccccc1)c2cccc(F)c2 Amb6360834 [0,2,0,0,0,0|1,0,1]=4 1588 B18R2.6463 O=C(NCc1ccccc1)c2cccc(I)c2 Amb1220275 [0,2,0,0,0,0|1,0,1]=4 1589 B18R2.6463 O=C(NCc1ccccc1)c2cccc(O)c2 Amb2272540 [0,2,0,0,0,0|1,0,1]=4 1590 B18R2.6463 O=C(NCc1ccccc1)c2cccc(S)c2 Amb28069601 [0,2,0,0,0,0|1,0,1]=4 1591 B18R2.6463 O=C(OCc1ccccc1)c2cccc(Br)c2 Amb5097157 [0,2,0,0,0,0|0,0,1]=3 1592 B18R2.6463 O=C(OCc1ccccc1)c2cccc(F)c2 Amb4758087 [0,2,0,0,0,0|0,0,1]=3 1593 B18R2.6463 O=C(OCc1ccccc1)c2cccc(F)n2 Amb27211674 [0,2,0,0,0,0|1,0,1]=4 1594 B18R2.6463 O=C(OCc1ccccc1)c2cccc(I)c2 Amb4936897 [0,2,0,0,0,0|0,0,1]=3 1595 B18R2.6463 O=C(OCc1ccccc1)c2cccc(O)c2 Amb9828589 [0,2,0,0,0,0|0,0,1]=3 1596 B18R2.6463 O=C(OCc1ccccc1)c2ccnc(Br)c2 Amb27811482 [0,2,0,0,0,0|1,0,1]=4 1597 B18R2.6463 OC(CNc1ccccc1)c2cccc(Cl)c2 Amb17160257 [0,2,0,0,0,0|2,0,0]=4 1598 B18R2.6467 CC(NCc1cccc(Br)c1)c2ccccc2 Amb2684963 [0,2,0,0,0,0|1,0,0]=3 1599 B18R2.6467 CC(NCc1cccc(Cl)c1)c2ccccc2 Amb6684899 [0,2,0,0,0,0|1,0,0]=3 1600 B18R2.6467 CC(NCc1cccc(F)c1)c2ccccc2 Amb6684791 [0,2,0,0,0,0|1,0,0]=3 1601 B18R2.6467 CC(NCc1cccc(O)c1)c2ccccc2 Amb6684903 [0,2,0,0,0,0|1,0,0]=3 1602 B18R2.6467 CN(CCc1cccc(N)c1)c2ccccc2 Amb17050655 [0,2,0,0,0,0|2,0,0]=4 1603 B18R2.6467 Cc1cccc(CCC(N)c2ccccc2)c1 Amb5737007 [0,2,0,0,0,0|1,0,0]=3 1604 B18R2.6467 Cc1cccc(CNC(C)c2ccccc2)c1 Amb3692312 [0,2,0,0,0,0|1,0,0]=3 1605 B18R2.6467 Cc1cccc(CNC(C)c2ccccc2)c1 Amb6537883 [0,2,0,0,0,0|1,0,0]=3 1606 B18R2.6467 Cc1cccc(NCC(O)c2ccccc2)c1 Amb17142322 [0,2,0,0,0,0|2,0,0]=4 1607 B18R2.6467 Cc1cccc(OCC(N)c2ccccc2)c1 Amb1134913 [0,2,0,0,0,0|2,0,0]=4 1608 B18R2.6467 NC(CCc1cccc(Cl)c1)c2ccccc2 Amb5737016 [0,2,0,0,0,0|1,0,0]=3 1609 B18R2.6467 NC(CCc1cccc(F)c1)c2ccccc2 Amb35751034 [0,2,0,0,0,0|1,0,0]=3 1610 B18R2.6467 NC(CCc1cccc(F)c1)c2ccccc2 Amb9031732 [0,2,0,0,0,0|1,0,0]=3 1611 B18R2.6467 Nc1cccc(CCC(O)c2ccccc2)c1 Amb19514677 [0,2,0,0,0,0|1,0,0]=3 1612 B18R2.6467 OC(CNc1cccc(Cl)c1)c2ccccc2 Amb17160254 [0,2,0,0,0,0|2,0,0]=4 1613 B18R2.6467 OC(CNc1cccc(Cl)c1)c2ccccc2 Amb24089790 [0,2,0,0,0,0|2,0,0]=4 1614 B18R2.6467 OC(CNc1cccc(F)c1)c2ccccc2 Amb17142721 [0,2,0,0,0,0|2,0,0]=4 1615 B18R2.32237 CC(O)(C#Cc1ccccc1)c2ccccc2 Amb2234010 [0,2,0,0,0,0|1,0,1]=4 1616 B18R2.32237 O=S(=O)(NCc1ccccc1)c2ccccc2 Amb6358919 [0,2,0,0,0,0|2,0,0]=4 1617 B18R2.32237 O=S(=O)(OCc1ccccc1)c2ccccc2 Amb22054410 [0,2,0,0,0,0|1,0,0]=3 1618 B18R2.445 COc1ccccc1CNCc2ccccc2 Amb6355519 [0,2,0,0,0,0|1,0,0]=3 1619 B18R2.445 COc1ccccc1CNCc2ccccn2 Amb2689105 [0,2,0,0,0,0|2,0,0]=4 1620 B18R2.445 COc1ccccc1CNCc2cccnc2 Amb22587898 [0,2,0,0,0,0|2,0,0]=4 1621 B18R2.445 COc1ccccc1CNCc2cccnc2 Amb6355738 [0,2,0,0,0,0|2,0,0]=4 1622 B18R2.445 COc1ccccc1CNCc2ccncc2 Amb6355464 [0,2,0,0,0,0|2,0,0]=4 1623 B18R2.445 COc1ncccc1CNCc2ccccc2 Amb19344267 [0,2,0,0,0,0|2,0,0]=4 1624 B18R2.445 N#Cc1cccnc1NOCc2ccccc2 Amb24431058 [0,2,0,0,0,0|2,0,0]=4 1625 B18R2.445 N#Cc1ncccc1CNCc2ccccc2 Amb28186165 [0,2,0,0,0,0|2,0,0]=4 1626 B18R2.445 NCc1ccccc1COCc2ccccc2 Amb1138582 [0,2,0,0,0,0|0,0,0]=2 1627 B18R2.445 NCc1ccccc1OCCc2ccccc2 Amb1112606 [0,2,0,0,0,0|2,0,0]=4 1628 B18R2.445 NCc1ncccc1COCc2ccccc2 Amb27181362 [0,2,0,0,0,0|1,0,0]=3 1629 B18R2.445 NNc1ncccc1COCc2ccccc2 Amb27209508 [0,2,0,0,0,0|1,0,0]=3 1630 B18R2.445 O=Cc1ccccc1COCc2ccccc2 Amb18659453 [0,2,0,0,0,0|0,0,0]=2 1631 B18R2.445 O=Cc1ccccc1OCCc2ccccc2 Amb2776824 [0,2,0,0,0,0|2,0,0]=4 1632 B18R2.445 OCc1ccccc1CNCc2ccccc2 Amb1058113 [0,2,0,0,0,0|1,0,0]=3 1633 B18R2.445 OCc1ccccc1CNCc2ccccc2 Amb2712481 [0,2,0,0,0,0|1,0,0]=3 1634 B18R2.3922 CC1=NC=CN(COCc2ccccc2)C1=O Amb28435050 [0,2,0,0,0,0|2,0,0]=4 1635 B18R2.3922 Clc1c(Br)cccc1CNCc2ccccc2 Amb27182067 [0,2,0,0,0,0|1,0,0]=3 1636 B18R2.3922 Clc1cccc(CNCc2ccccc2)c1Cl Amb6687474 [0,2,0,0,0,0|1,0,0]=3 1637 B18R2.3922 Clc1cccc(CNCc2ccccn2)c1Cl Amb1838096 [0,2,0,0,0,0|2,0,0]=4 1638 B18R2.3922 Clc1cccc(CNCc2cccnc2)c1Cl Amb1837863 [0,2,0,0,0,0|2,0,0]=4 1639 B18R2.3922 Fc1c(Cl)cccc1CNCc2ccccc2 Amb27979850 [0,2,0,0,0,0|1,0,0]=3 1640 B18R2.3922 Fc1cccc(CNCc2ccccc2)c1Cl Amb27968652 [0,2,0,0,0,0|1,0,0]=3 1641 B18R2.3922 NC1=CC=CN(COCc2ccccc2)C1=O Amb24332271 [0,2,0,0,0,0|1,0,0]=3 1642 B18R2.3922 O=C1C(Cl)=NC=CN1COCc2ccccc2 Amb27606813 [0,2,0,0,0,0|2,0,0]=4 1643 B18R2.6470 Brc1cncc(Br)c1CNCc2ccccc2 Amb25963003 [0,2,0,0,0,0|2,0,0]=4 1644 B18R2.6470 Cc1cccc(C)c1CNCc2ccccc2 Amb27946484 [0,2,0,0,0,0|1,0,0]=3 1645 B18R2.6470 Clc1cccc(Cl)c1CNCc2ccccc2 Amb2786751 [0,2,0,0,0,0|1,0,0]=3 1646 B18R2.6470 Clc1cccc(Cl)c1CNCc2ccccn2 Amb779563 [0,2,0,0,0,0|2,0,0]=4 1647 B18R2.6470 Clc1cccc(Cl)c1CNCc2cccnc2 Amb6456500 [0,2,0,0,0,0|2,0,0]=4 1648 B18R2.6470 Clc1cccc(Cl)c1CNCc2ccncc2 Amb1923392 [0,2,0,0,0,0|2,0,0]=4 1649 B18R2.6470 Fc1cccc(Br)c1CNCc2ccccc2 Amb24333307 [0,2,0,0,0,0|1,0,0]=3 1650 B18R2.6470 Fc1cccc(Cl)c1CNCc2ccccc2 Amb838188 [0,2,0,0,0,0|1,0,0]=3 1651 B18R2.6470 Fc1cccc(Cl)c1CNCc2ccccn2 Amb6412942 [0,2,0,0,0,0|2,0,0]=4 1652 B18R2.6470 Fc1cccc(Cl)c1CNCc2cccnc2 Amb6364683 [0,2,0,0,0,0|2,0,0]=4 1653 B18R2.6470 Fc1cccc(Cl)c1CNCc2ccncc2 Amb6729687 [0,2,0,0,0,0|2,0,0]=4 1654 B18R2.6470 Fc1cccc(F)c1NCCc2ccccc2 Amb7760086 [0,2,0,0,0,0|2,0,0]=4 1655 B18R2.6470 Fc1cncc(F)c1CNCc2ccccc2 Amb32993241 [0,2,0,0,0,0|2,0,0]=4 1656 B18R2.6470 O=C1C=CNC(=O)N1COCc2ccccc2 Amb28187811 [0,2,0,0,0,0|2,0,0]=4 1657 B18R2.6544 Cc1ccc(C)c(CNCc2ccccc2)c1 Amb17406763 [0,2,0,0,0,0|1,0,0]=3 1658 B18R2.6544 Cc1ccc(F)c(CNCc2ccccc2)c1 Amb28145718 [0,2,0,0,0,0|1,0,0]=3 1659 B18R2.6544 Cc1ccc(N)c(CNCc2ccccc2)c1 Amb18659533 [0,2,0,0,0,0|1,0,0]=3 1660 B18R2.6544 Cc1ccc(N)c(OCCc2ccccc2)c1 Amb6665230 [0,2,0,0,0,0|2,0,0]=4 1661 B18R2.6544 Cc1ccc(N)cc1OCCc2ccccc2 Amb9381493 [0,2,0,0,0,0|2,0,0]=4 1662 B18R2.6544 Fc1ccc(Br)c(COCc2ccccc2)c1 Amb27638318 [0,2,0,0,0,0|0,0,0]=2 1663 B18R2.6544 Fc1ccc(Br)cc1CNCc2ccccc2 Amb6687333 [0,2,0,0,0,0|1,0,0]=3 1664 B18R2.6544 Fc1ccc(Cl)c(CNCc2ccccc2)c1 Amb27462980 [0,2,0,0,0,0|1,0,0]=3 1665 B18R2.6544 Fc1ccc(F)c(CNCc2ccccc2)c1 Amb8945097 [0,2,0,0,0,0|1,0,0]=3 1666 B18R2.6544 NC1=CN(CCCc2ccccc2)C(=O)C=C1 Amb18535268 [0,2,0,0,0,0|2,0,0]=4 1667 B18R2.6544 NC1=CN(COCc2ccccc2)C(=O)C=C1 Amb26898395 [0,2,0,0,0,0|1,0,0]=3 1668 B18R2.6544 Oc1ccc(Br)c(CNCc2ccccc2)c1 Amb28458634 [0,2,0,0,0,0|1,0,0]=3 1669 B18R2.6544 Oc1ccc(Br)cc1CNCc2ccccc2 Amb8604222 [0,2,0,0,0,0|1,0,0]=3 1670 B18R2.6544 Oc1ccc(Cl)cc1CNCc2ccccc2 Amb6687423 [0,2,0,0,0,0|1,0,0]=3 1671 B18R2.6544 Oc1ccc(F)cc1CNCc2ccccn2 Amb23597513 [0,2,0,0,0,0|2,0,0]=4 1672 B18R2.6544 Oc1ccc(F)cc1CNCc2cccnc2 Amb23597522 [0,2,0,0,0,0|2,0,0]=4 1673 B18R2.6544 Oc1ccc(F)cc1CNCc2ccncc2 Amb23597521 [0,2,0,0,0,0|2,0,0]=4 1674 B18R2.32674 Cc1ccccc1CCOc2ccccc2N Amb17247795 [0,2,0,0,0,0|2,0,0]=4 1675 B18R2.32674 Cc1ccccc1CNCc2ccccc2C Amb17142098 [0,2,0,0,0,0|1,0,0]=3 1676 B18R2.32674 Cc1ccccc1CNCc2ccccc2Cl Amb6691720 [0,2,0,0,0,0|1,0,0]=3 1677 B18R2.32674 Cc1ccccc1CNCc2ccccc2F Amb6697900 [0,2,0,0,0,0|1,0,0]=3 1678 B18R2.32674 Clc1ccccc1CNCc2ccccc2Cl Amb6691711 [0,2,0,0,0,0|1,0,0]=3 1679 B18R2.32674 Fc1ccccc1CNCc2ccccc2Cl Amb6691808 [0,2,0,0,0,0|1,0,0]=3 1680 B18R2.32674 Fc1ccccc1CNCc2ccccc2F Amb6698028 [0,2,0,0,0,0|1,0,0]=3 1681 B18R2.32674 Nc1ccccc1COCc2ccccc2N Amb10609967 [0,2,0,0,0,0|0,0,0]=2 1682 B18R2.32674 Nc1ccccc1OCCc2ccccc2Cl Amb17259640 [0,2,0,0,0,0|2,0,0]=4 1683 B18R2.32674 Nc1ccccc1OCCc2ccccc2F Amb17249421 [0,2,0,0,0,0|2,0,0]=4 1684 B18R2.32674 Oc1ccccc1CNCc2ccccc2O Amb17777805 [0,2,0,0,0,0|1,0,0]=3 1685 B18R2.65882 Cc1cccc(CCOc2ccccc2N)c1 Amb17247796 [0,2,0,0,0,0|2,0,0]=4 1686 B18R2.65882 Cc1cccc(CNCc2ccccc2C)c1 Amb6728533 [0,2,0,0,0,0|1,0,0]=3 1687 B18R2.65882 Cc1cccc(CNCc2ccccc2Cl)c1 Amb6691723 [0,2,0,0,0,0|1,0,0]=3 1688 B18R2.65882 Cc1cccc(CNCc2ccccc2F)c1 Amb6697902 [0,2,0,0,0,0|1,0,0]=3 1689 B18R2.65882 Cc1ccccc1CCCc2cccc(N)c2 Amb13953225 [0,2,0,0,0,0|1,0,0]=3 1690 B18R2.65882 Cc1ccccc1CCOc2cccc(N)c2 Amb17247780 [0,2,0,0,0,0|2,0,0]=4 1691 B18R2.65882 Cc1ccccc1CNCc2cccc(Cl)c2 Amb17159838 [0,2,0,0,0,0|1,0,0]=3 1692 B18R2.65882 Cc1ccccc1CNCc2cccc(F)c2 Amb7756794 [0,2,0,0,0,0|1,0,0]=3 1693 B18R2.65882 Cc1ccccc1CNCc2cccc(O)c2 Amb17142307 [0,2,0,0,0,0|1,0,0]=3 1694 B18R2.65882 Clc1cccc(CNCc2ccccc2Cl)c1 Amb6691803 [0,2,0,0,0,0|1,0,0]=3 1695 B18R2.65882 Fc1cccc(CNCc2ccccc2Br)c1 Amb9207664 [0,2,0,0,0,0|1,0,0]=3 1696 B18R2.65882 Fc1cccc(CNCc2ccccc2Cl)c1 Amb6691719 [0,2,0,0,0,0|1,0,0]=3 1697 B18R2.65882 Fc1cccc(CNCc2ccccc2F)c1 Amb6697898 [0,2,0,0,0,0|1,0,0]=3 1698 B18R2.65882 Fc1ccccc1CNCc2cccc(Cl)c2 Amb6698021 [0,2,0,0,0,0|1,0,0]=3 1699 B18R2.65882 Nc1cccc(CCCc2ccccc2F)c1 Amb13953222 [0,2,0,0,0,0|1,0,0]=3 1700 B18R2.65882 Nc1cccc(OCCc2ccccc2Cl)c1 Amb17259635 [0,2,0,0,0,0|2,0,0]=4 1701 B18R2.65882 Nc1cccc(OCCc2ccccc2F)c1 Amb17249415 [0,2,0,0,0,0|2,0,0]=4 1702 B18R2.65882 Nc1ccccc1OCCc2cccc(Cl)c2 Amb17259641 [0,2,0,0,0,0|2,0,0]=4 1703 B18R2.65882 Oc1cccc(CNCc2ccccc2Cl)c1 Amb6691805 [0,2,0,0,0,0|1,0,0]=3 1704 B18R2.65882 Oc1cccc(CNCc2ccccc2F)c1 Amb6698024 [0,2,0,0,0,0|1,0,0]=3 1705 B18R2.65882 Oc1ccccc1CNCc2cccc(F)c2 Amb9207667 [0,2,0,0,0,0|1,0,0]=3 1706 B18R2.1508 BrCc1cccc(OCCc2ccccc2)c1 Amb8835698 [0,2,0,0,0,0|2,0,0]=4 1707 B18R2.1508 C#Cc1cccc(OCCc2ccccc2)c1 Amb32410291 [0,2,0,0,0,0|2,0,0]=4 1708 B18R2.1508 CNc1cccc(COCc2ccccc2)n1 Amb27228537 [0,2,0,0,0,0|1,0,0]=3 1709 B18R2.1508 COc1cc(CNCc2ccccc2)ccn1 Amb27444912 [0,2,0,0,0,0|2,0,0]=4 1710 B18R2.1508 COc1cccc(CNCc2ccccc2)c1 Amb6352464 [0,2,0,0,0,0|1,0,0]=3 1711 B18R2.1508 COc1cccc(CNCc2ccccn2)c1 Amb1837955 [0,2,0,0,0,0|2,0,0]=4 1712 B18R2.1508 COc1cccc(CNCc2cccnc2)c1 Amb6355618 [0,2,0,0,0,0|2,0,0]=4 1713 B18R2.1508 COc1cccc(CNCc2ccncc2)c1 Amb6729565 [0,2,0,0,0,0|2,0,0]=4 1714 B18R2.1508 COc1cccc(COCc2ccccc2)c1 Amb22749710 [0,2,0,0,0,0|0,0,0]=2 1715 B18R2.1508 CSc1cccc(NCCc2ccccc2)c1 Amb6687707 [0,2,0,0,0,0|2,0,0]=4 1716 B18R2.1508 N#Cc1cc(CNCc2ccccc2)ccn1 Amb27975164 [0,2,0,0,0,0|2,0,0]=4 1717 B18R2.1508 NCc1cccc(COCc2ccccc2)c1 Amb1141891 [0,2,0,0,0,0|0,0,0]=2 1718 B18R2.1508 NNc1nccc(COCc2ccccc2)n1 Amb27189896 [0,2,0,0,0,0|2,0,0]=4 1719 B18R2.1508 O=Cc1cccc(OCCc2ccccc2)c1 Amb836321 [0,2,0,0,0,0|2,0,0]=4 1720 B18R2.1508 O=Cc1ccnc(COCc2ccccc2)n1 Amb27615102 [0,2,0,0,0,0|2,0,0]=4 1721 B18R2.1508 OCc1ccnc(COCc2ccccc2)n1 Amb27442780 [0,2,0,0,0,0|2,0,0]=4 1722 B18R2.3665 CC1=CC(=O)NC(COCc2ccccc2)=N1 Amb28458629 [0,2,0,0,0,0|2,0,0]=4 1723 B18R2.3665 Cc1cc(Cl)cc(CNCc2ccccc2)c1 Amb28280390 [0,2,0,0,0,0|1,0,0]=3 1724 B18R2.3665 Fc1cc(Br)cc(CNCc2ccccc2)c1 Amb28365415 [0,2,0,0,0,0|1,0,0]=3 1725 B18R2.3665 Nc1cc(Br)cc(COCc2ccccc2)c1 Amb28367993 [0,2,0,0,0,0|0,0,0]=2 1726 B18R2.3665 Nc1nc(O)cc(COCc2ccccc2)n1 Amb27763714 [0,2,0,0,0,0|2,0,0]=4 1727 B18R2.3665 O=C1C=C(O)N=C(COCc2ccccc2)N1 Amb27491270 [0,2,0,0,0,0|2,0,0]=4 1728 B18R2.6482 Cc1cccc(CCCc2cccc(N)c2)c1 Amb13953223 [0,2,0,0,0,0|1,0,0]=3 1729 B18R2.6482 Cc1cccc(CCOc2cccc(N)c2)c1 Amb17247783 [0,2,0,0,0,0|2,0,0]=4 1730 B18R2.6482 Cc1cccc(CNCc2cccc(C)c2)c1 Amb6728535 [0,2,0,0,0,0|1,0,0]=3 1731 B18R2.6482 Cc1cccc(CNCc2cccc(Cl)c2)c1 Amb6728622 [0,2,0,0,0,0|1,0,0]=3 1732 B18R2.6482 Cc1cccc(CNCc2cccc(O)c2)c1 Amb6728626 [0,2,0,0,0,0|1,0,0]=3 1733 B18R2.6482 Fc1cccc(CNCc2cccc(Br)c2)c1 Amb9207676 [0,2,0,0,0,0|1,0,0]=3 1734 B18R2.6482 Fc1cccc(CNCc2cccc(F)c2)c1 Amb9207674 [0,2,0,0,0,0|1,0,0]=3 1735 B18R2.6482 Nc1cccc(CCCc2cccc(F)c2)c1 Amb13953221 [0,2,0,0,0,0|1,0,0]=3 1736 B18R2.6482 Nc1cccc(CCCc2cccc(O)c2)c1 Amb13953224 [0,2,0,0,0,0|1,0,0]=3 1737 B18R2.6482 Nc1cccc(OCCc2cccc(Cl)c2)c1 Amb17259637 [0,2,0,0,0,0|2,0,0]=4 1738 B16R3.9 c1cc[n+]2c(c1)-c3cccc[n+]3CC2 Amb2708103 [0,0,0,1,1,0|2,0,0]=4 1739 B16R3.9 c1ccc-2c(c1)CCc3ccccc32 Amb17672017 [0,0,0,1,1,0|0,0,0]=2 1740 B16R3.9 c1ccc-2c(c1)CCc3cncnc32 Amb23401185 [0,0,0,1,1,0|2,0,0]=4 1741 B16R3.9 c1ccc-2c(c1)CCc3ncccc32 Amb27402349 [0,0,0,1,1,0|1,0,0]=3 1742 B16R3.9 c1ccc-2c(c1)CNc3ccccc32 Amb32665195 [0,0,0,1,1,0|1,0,0]=3 1743 B16R3.9 c1ccc-2c(c1)CNc3ccccc32 Amb9201095 [0,0,0,1,1,0|1,0,0]=3 1744 B16R3.9 c1ccc-2c(c1)NCc3cnccc32 Amb27412036 [0,0,0,1,1,0|2,0,0]=4 1745 B16R3.9 c1ccc-2c(c1)SSc3ccccc32 Amb27756332 [0,0,0,1,1,0|1,1,0]=4 1746 B16R3.9 c1ccc2c(c1)ccc3ccccc32 Amb6297759 [0,0,0,1,1,0|0,0,2]=4 1747 B16R3.9 c1ccc2c(c1)cnc3ccccc32 Amb2609985 [0,0,0,1,1,0|1,0,1]=4 1748 B16R3.9 c1ccc2c(c1)nnc3ccccc32 Amb2746830 [0,0,0,1,1,0|2,0,0]=4 1749 B16R3.9 c1cnc-2c(c1)COc3ccccc32 Amb28347446 [0,0,0,1,1,0|1,0,0]=3 1750 B16R3.1783 c1ccc(C2Cc3ccccc32)cc1 Amb17778867 [0,0,0,1,1,0|0,0,0]=2 1751 B16R3.1783 c1ccc(C2Cc3ccccc32)nc1 Amb17778880 [0,0,0,1,1,0|1,0,0]=3 1752 B16R3.8 c1ccc2c(c1)CNC2c3ccsc3 Amb27949781 [0,0,0,1,1,0|2,0,0]=4 1753 B16R3.8 c1csc(C2NCc3ccccc32)c1 Amb25181983 [0,0,0,1,1,0|2,0,0]=4 1754 B16R3.1782 c1ccc(C2CC2n3cccc3)cc1 Amb19074384 [0,0,0,1,1,0|2,0,0]=4 1755 B16R3.1812 c1ccc-2c(c1)CNCc3cccn32 Amb28135341 [0,0,0,1,1,0|2,0,0]=4 1756 B18R3.2098 c1ccc(CC2CNc3ccccc32)cc1 Amb17240364 [0,0,0,1,0,1|1,0,0]=3 1757 B18R3.2098 c1ccc(CC2NCc3ccccc32)cc1 Amb31117817 [0,0,0,1,0,1|1,0,0]=3 1758 B18R3.2098 c1ccc(CN2CCc3ccccc32)cc1 Amb10610016 [0,0,0,1,0,1|1,0,0]=3 1759 B18R3.2098 c1ccc(CN2CSc3ccccc32)cc1 Amb3984940 [0,0,0,1,0,1|1,0,0]=3 1760 B18R3.2098 c1ccc(C[n+]2csc3ccccc32)cc1 Amb3993671 [0,0,0,1,0,1|1,0,1]=4 1761 B18R3.2098 c1ccc(Cn2ccc3ccccc32)cc1 Amb6353698 [0,0,0,1,0,1|1,0,1]=4 1762 B18R3.2098 c1ccc(Cn2cnc3ccccc32)cc1 Amb1219763 [0,0,0,1,0,1|1,0,1]=4 1763 B18R3.2098 c1ccc(Cn2ncc3ccccc32)cc1 Amb8563492 [0,0,0,1,0,1|1,0,1]=4 1764 B18R3.2098 c1ccc(Cn2nnc3ccccc32)cc1 Amb6360273 [0,0,0,1,0,1|2,0,0]=4 1765 B18R3.2098 c1cncc(CC2CNc3ccccc32)c1 Amb17240642 [0,0,0,1,0,1|2,0,0]=4 1766 B18R3.2100 c1ccc(CNC2Cc3ccccc32)cc1 Amb27218139 [0,0,0,1,0,1|1,0,0]=3 1767 B18R3.2108 c1ccc(C2=NCCc3ccccc32)cc1 Amb5717737 [0,0,0,1,0,1|1,0,1]=4 1768 B18R3.2108 c1ccc(C2=NCCc3ccccc32)cc1 Amb6773288 [0,0,0,1,0,1|1,0,1]=4 1769 B18R3.2108 c1ccc(C2CCCc3ccccc32)cc1 Amb32665339 [0,0,0,1,0,1|1,0,0]=3 1770 B18R3.2108 c1ccc(C2CCNc3ccccc32)cc1 Amb32670838 [0,0,0,1,0,1|1,0,0]=3 1771 B18R3.2108 c1ccc(C2CNCc3ccccc32)cc1 Amb2606131 [0,0,0,1,0,1|1,0,0]=3 1772 B18R3.2108 c1ccc(C2CNCc3ccccc32)cc1 Amb329182 [0,0,0,1,0,1|1,0,0]=3 1773 B18R3.2108 c1ccc(C2NCCc3ccccc32)cc1 Amb2567931 [0,0,0,1,0,1|1,0,0]=3 1774 B18R3.2108 c1ccc(C2NCCc3ccccc32)nc1 Amb2795565 [0,0,0,1,0,1|2,0,0]=4 1775 B18R3.2108 c1ccc([C@@H]2NCCc3ccccc32)cc1 Amb19892402 [0,0,0,1,0,1|1,0,0]=3 1776 B18R3.2108 c1ccc([C@H]2NCCc3ccccc32)cc1 Amb8396118 [0,0,0,1,0,1|1,0,0]=3 1777 B18R3.2108 c1ccc2c(c1)CCNC2c3ccncc3 Amb1420331 [0,0,0,1,0,1|2,0,0]=4 1778 B18R3.2108 c1ccc2c(c1)NCCC2c3ccncc3 Amb32671923 [0,0,0,1,0,1|2,0,0]=4 1779 B18R3.2108 c1cncc(C2CCNc3ccccc32)c1 Amb32671692 [0,0,0,1,0,1|2,0,0]=4 1780 B18R3.2108 c1cncc(C2NCCc3ccccc32)c1 Amb2795564 [0,0,0,1,0,1|2,0,0]=4 1781 B18R3.2122 c1ccc(CC2OC2c3ccccc3)cc1 Amb9708379 [0,0,0,1,0,1|0,0,0]=2 1782 B18R3.176 O=C1Cc2ccccc2-c3ccccc3C1 Amb2677296 [0,1,0,1,0,0|1,0,0]=3 1783 B18R3.176 O=C1Cc2ccccc2-c3ccccc3N1 Amb17612489 [0,1,0,1,0,0|2,0,0]=4 1784 B18R3.182 CC1=C(c2ccccc2)c3ccccc3C1 Amb17778908 [0,1,0,1,0,0|1,0,1]=4 1785 B18R3.182 O=C1Cc2ccccc2N1c3ccccc3 Amb1261607 [0,1,0,1,0,0|2,0,0]=4 1786 B18R3.182 O=C1Nc2ccccc2C1c3ccccc3 Amb2615574 [0,1,0,1,0,0|2,0,0]=4 1787 B18R3.12875 c1ccc(CC2Cc3ccccc3N2)cc1 Amb32668739 [0,1,0,1,0,0|1,0,0]=3 1788 B18R3.12875 c1ccc(CN2Cc3cccnc3C2)cc1 Amb2696565 [0,1,0,1,0,0|2,0,0]=4 1789 B18R3.12875 c1ccc(Cc2nc3ccccc3o2)cc1 Amb4397320 [0,1,0,1,0,0|2,0,0]=4 1790 B18R3.12875 c1ccc(Cc2nc3ccccc3s2)cc1 Amb22536369 [0,1,0,1,0,0|2,0,0]=4 1791 B18R3.12875 c1ccc(Cn2cc3ccccc3n2)cc1 Amb22371691 [0,1,0,1,0,0|1,0,1]=4 1792 B18R3.12875 c1ccc(NC2Cc3ccccc3C2)cc1 Amb9373551 [0,1,0,1,0,0|2,0,0]=4 1793 B18R3.48 Cc1ccc(C2NCc3ccccc32)cc1 Amb31117820 [0,1,0,1,0,0|1,0,0]=3 1794 B18R3.48 Clc1ccc(C2NCc3ccccc32)cc1 Amb31118437 [0,1,0,1,0,0|1,0,0]=3 1795 B18R3.48 Fc1ccc(C2NCc3ccccc32)cc1 Amb31135400 [0,1,0,1,0,0|1,0,0]=3 1796 B18R3.48 Nc1ccc(N2CCc3ccccc32)cc1 Amb1138826 [0,1,0,1,0,0|2,0,0]=4 1797 B18R3.4253 Clc1ccc2noc(-c3ccccc3)c2c1 Amb1149050 [0,1,0,1,0,0|1,0,1]=4 1798 B18R3.2123 c1ccc(C2CCc3ccccc3C2)cc1 Amb17844056 [0,1,0,1,0,0|1,0,0]=3 1799 B18R3.2123 c1ccc(C2CCc3ccccc3N2)cc1 Amb20667802 [0,1,0,1,0,0|1,0,0]=3 1800 B18R3.2123 c1ccc(C2CCc3ccccc3N2)cc1 Amb33546125 [0,1,0,1,0,0|1,0,0]=3 1801 B18R3.2123 c1ccc(C2CCc3ccccc3O2)nc1 Amb24070226 [0,1,0,1,0,0|2,0,0]=4 1802 B18R3.2123 c1ccc(C2CNc3ccccc3C2)cc1 Amb22034633 [0,1,0,1,0,0|2,0,0]=4 1803 B18R3.2123 c1ccc(C2CNc3ccccc3C2)cc1 Amb5746237 [0,1,0,1,0,0|2,0,0]=4 1804 B18R3.2123 c1ccc(C2CNc3ccccc3N2)cc1 Amb10606108 [0,1,0,1,0,0|2,0,0]=4 1805 B18R3.2123 c1ccc(C2COc3ccccc3N2)cc1 Amb23584702 [0,1,0,1,0,0|2,0,0]=4 1806 B18R3.2123 c1ccc(C2CSc3ccccc3N2)cc1 Amb1106073 [0,1,0,1,0,0|2,0,0]=4 1807 B18R3.2123 c1ccc(C2CSc3ccccc3N2)cc1 Amb2329242 [0,1,0,1,0,0|2,0,0]=4 1808 B18R3.2123 c1ccc(C2Cc3ccccc3CN2)cc1 Amb20668497 [0,1,0,1,0,0|1,0,0]=3 1809 B18R3.2123 c1ccc(C2Cc3ccccc3CN2)cc1 Amb2606132 [0,1,0,1,0,0|1,0,0]=3 1810 B18R3.2123 c1ccc(N2CCc3ccccc3C2)cc1 Amb18452320 [0,1,0,1,0,0|2,0,0]=4 1811 B18R3.11551 CC1=CC(c2ccccc2)c3ccccc31 Amb17778891 [0,1,0,1,0,0|1,0,1]=4 1812 B18R3.11551 CC1CC(c2ccccc2)c3ccccc31 Amb15693430 [0,1,0,1,0,0|1,0,0]=3 1813 B18R3.11551 ClC1=CC(c2ccccc2)c3ccccc31 Amb17778881 [0,1,0,1,0,0|1,0,1]=4 1814 B18R3.11551 O=C1CC(c2ccccc2)c3ccccc31 Amb2440340 [0,1,0,1,0,0|1,0,1]=4 1815 B18R3.11551 O=C1NC(c2ccccc2)c3ccccc31 Amb842452 [0,1,0,1,0,0|1,0,1]=4 1816 B18R3.11551 O=C1OC(c2ccccc2)c3ccccc31 Amb2617108 [0,1,0,1,0,0|0,0,1]=3 1817 B18R3.11551 OB1OC(c2ccccc2)c3ccccc31 Amb32669762 [0,1,0,1,0,0|1,0,0]=3 1818 B18R3.38448 CC1(c2ccccc2)C=Cc3ccccc31 Amb17778906 [0,1,0,1,0,0|1,0,1]=4 1819 B18R3.38448 CC1(c2ccccc2)C=Nc3ccccc31 Amb17843919 [0,1,0,1,0,0|2,0,0]=4 1820 B18R3.38448 CC1(c2ccccc2)C=Nc3ccccc31 Amb17843920 [0,1,0,1,0,0|2,0,0]=4 1821 B18R3.38448 OC1(c2cccnc2)CCc3ccccc31 Amb33733630 [0,1,0,1,0,0|2,0,0]=4 1822 B18R3.112707 O=C1OCc2ccccc2-c3ccccc31 Amb4012243 [0,1,0,1,0,0|0,0,1]=3 1823 B18R3.102 Cc1ccccc1C2NCc3ccccc32 Amb31117818 [0,1,0,1,0,0|1,0,0]=3 1824 B18R3.102 Clc1ccccc1C2NCc3ccccc32 Amb31118435 [0,1,0,1,0,0|1,0,0]=3 1825 B18R3.102 Fc1ccccc1C2NCc3ccccc32 Amb31135398 [0,1,0,1,0,0|1,0,0]=3 1826 B18R3.102 Nc1ccccc1N2CCc3ccccc32 Amb1127844 [0,1,0,1,0,0|2,0,0]=4 1827 B18R3.102 Nc1ccccc1N2CCc3ccccc32 Amb6892779 [0,1,0,1,0,0|2,0,0]=4 1828 B18R3.50 Cc1cccc(C2NCc3ccccc32)c1 Amb31117819 [0,1,0,1,0,0|1,0,0]=3 1829 B18R3.50 Clc1cccc(C2NCc3ccccc32)c1 Amb31118436 [0,1,0,1,0,0|1,0,0]=3 1830 B18R3.50 Fc1cccc(C2NCc3ccccc32)c1 Amb31135399 [0,1,0,1,0,0|1,0,0]=3 1831 B18R4.13257 c1cnc-2c(c1)C3OC3c4cccnc42 Amb1395266 [0,0,0,2,0,0|2,0,0]=4 1832 B14R2.6 c1cc(Cc2ccncc2)ccn1 Amb25336509 [0,0,0,0,2,0|2,0,0]=4 1833 B14R2.6 c1cc[n+](Cc2ccccn2)cc1 Amb2613484 [0,0,0,0,2,0|2,0,0]=4 1834 B14R2.6 c1cc[n+](Cc2ccccn2)cc1 Amb4005979 [0,0,0,0,2,0|2,0,0]=4 1835 B14R2.6 c1ccc(C[n+]2ccccc2)cc1 Amb4009585 [0,0,0,0,2,0|1,0,0]=3 1836 B14R2.6 c1ccc(Cc2cc[nH+]cc2)cc1 Amb4027559 [0,0,0,0,2,0|1,0,0]=3 1837 B14R2.6 c1ccc(Cc2ccccc2)cc1 Amb6357390 [0,0,0,0,2,0|0,0,0]=2 1838 B14R2.6 c1ccc(Cc2ccccn2)cc1 Amb2610000 [0,0,0,0,2,0|1,0,0]=3 1839 B14R2.6 c1ccc(Cc2cccnc2)cc1 Amb5718939 [0,0,0,0,2,0|1,0,0]=3 1840 B14R2.6 c1ccc(Cc2ccncc2)cc1 Amb2609983 [0,0,0,0,2,0|1,0,0]=3 1841 B14R2.6 c1ccc(Cc2cnccn2)cc1 Amb22263670 [0,0,0,0,2,0|2,0,0]=4 1842 B14R2.6 c1ccc(Nc2ccccc2)cc1 Amb1215248 [0,0,0,0,2,0|1,0,0]=3 1843 B14R2.6 c1ccc(Nc2ccccc2)cc1 Amb6365657 [0,0,0,0,2,0|1,0,0]=3 1844 B14R2.6 c1ccc(Nc2ccccn2)cc1 Amb1151333 [0,0,0,0,2,0|2,0,0]=4 1845 B14R2.6 c1ccc(Nc2ccncc2)cc1 Amb6296876 [0,0,0,0,2,0|2,0,0]=4 1846 B14R2.6 c1ccc(Oc2ccccc2)cc1 Amb6355877 [0,0,0,0,2,0|0,0,0]=2 1847 B14R2.6 c1ccc(Oc2ccccc2)cc1 Amb8516759 [0,0,0,0,2,0|0,0,0]=2 1848 B14R2.6 c1ccc(Oc2ccccn2)cc1 Amb10553559 [0,0,0,0,2,0|1,0,0]=3 1849 B14R2.6 c1ccc(Oc2ccccn2)nc1 Amb27945988 [0,0,0,0,2,0|2,0,0]=4 1850 B14R2.6 c1ccc(Oc2cccnc2)cc1 Amb8394912 [0,0,0,0,2,0|1,0,0]=3 1851 B14R2.6 c1ccc(Oc2cccnn2)cc1 Amb24441314 [0,0,0,0,2,0|2,0,0]=4 1852 B14R2.6 c1ccc(Oc2ccncc2)cc1 Amb2610105 [0,0,0,0,2,0|1,0,0]=3 1853 B14R2.6 c1ccc(Oc2ccnnc2)cc1 Amb23592135 [0,0,0,0,2,0|2,0,0]=4 1854 B14R2.6 c1ccc(Oc2cncnc2)cc1 Amb24098659 [0,0,0,0,2,0|2,0,0]=4 1855 B14R2.6 c1ccc(Oc2ncccn2)cc1 Amb10671160 [0,0,0,0,2,0|2,0,0]=4 1856 B14R2.6 c1ccc(Pc2ccccc2)cc1 Amb6365840 [0,0,0,0,2,0|1,0,0]=3 1857 B14R2.6 c1ccc(Pc2ccccn2)cc1 Amb27254129 [0,0,0,0,2,0|2,0,0]=4 1858 B14R2.6 c1ccc(Sc2ccccc2)cc1 Amb6608801 [0,0,0,0,2,0|0,1,0]=3 1859 B14R2.6 c1ccc(Sc2ccccn2)cc1 Amb2610106 [0,0,0,0,2,0|1,1,0]=4 1860 B14R2.6 c1ccc(Sc2cccnc2)cc1 Amb10573261 [0,0,0,0,2,0|1,1,0]=4 1861 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb10601891 [0,0,0,0,2,0|1,0,0]=3 1862 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb10840230 [0,0,0,0,2,0|1,0,0]=3 1863 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb10841525 [0,0,0,0,2,0|1,0,0]=3 1864 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb22263754 [0,0,0,0,2,0|1,0,0]=3 1865 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb32620366 [0,0,0,0,2,0|1,0,0]=3 1866 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb4006513 [0,0,0,0,2,0|1,0,0]=3 1867 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb6296651 [0,0,0,0,2,0|1,0,0]=3 1868 B14R2.6 c1ccc([I+]c2ccccc2)cc1 Amb6366850 [0,0,0,0,2,0|1,0,0]=3 1869 B14R2.6 c1ccc([Pt]c2ccccc2)cc1 Amb22234096 [0,0,0,0,2,0|1,0,0]=3 1870 B14R2.6 c1ccc([Se]c2ccccc2)cc1 Amb8515146 [0,0,0,0,2,0|0,1,0]=3 1871 B14R2.6 c1ccc([SiH2]c2ccccc2)cc1 Amb8515711 [0,0,0,0,2,0|0,1,0]=3 1872 B14R2.101 c1cc(CCc2ccsc2)ccn1 Amb25999102 [0,0,0,0,2,0|2,0,0]=4 1873 B14R2.101 c1ccc(CCc2cnco2)cc1 Amb22753570 [0,0,0,0,2,0|2,0,0]=4 1874 B14R2.101 c1ccc(CCc2nccs2)cc1 Amb28122204 [0,0,0,0,2,0|2,0,0]=4 1875 B14R2.101 c1ccc(CCn2cccc2)cc1 Amb1067085 [0,0,0,0,2,0|1,0,0]=3 1876 B14R2.101 c1ccc(CCn2cccn2)cc1 Amb20622458 [0,0,0,0,2,0|2,0,0]=4 1877 B14R2.101 c1ccc(CCn2ccnc2)cc1 Amb10179875 [0,0,0,0,2,0|2,0,0]=4 1878 B14R2.101 c1ccc(CNc2ccco2)cc1 Amb25380740 [0,0,0,0,2,0|2,0,0]=4 1879 B14R2.101 c1ccc(COc2ccsn2)cc1 Amb24179171 [0,0,0,0,2,0|2,0,0]=4 1880 B14R2.101 c1ccc(COc2nccs2)cc1 Amb26059375 [0,0,0,0,2,0|2,0,0]=4 1881 B14R2.101 c1ccc(COn2cccn2)cc1 Amb10067877 [0,0,0,0,2,0|2,0,0]=4 1882 B14R2.101 c1ccc(CSc2cccs2)cc1 Amb27753630 [0,0,0,0,2,0|1,1,0]=4 1883 B14R2.101 c1ccc(CSc2ccsc2)cc1 Amb8444986 [0,0,0,0,2,0|1,1,0]=4 1884 B14R2.101 c1ccc(NCc2ccco2)cc1 Amb1669289 [0,0,0,0,2,0|2,0,0]=4 1885 B14R2.101 c1ccc(NCc2cccs2)cc1 Amb4399614 [0,0,0,0,2,0|2,0,0]=4 1886 B14R2.101 c1ccc(NCc2ccsc2)cc1 Amb13952328 [0,0,0,0,2,0|2,0,0]=4 1887 B14R2.101 c1ccc(NCc2ccsc2)cc1 Amb6685084 [0,0,0,0,2,0|2,0,0]=4 1888 B14R2.101 c1ccc(OCc2ccco2)cc1 Amb1352023 [0,0,0,0,2,0|1,0,0]=3 1889 B14R2.101 c1ccc(OCc2ccns2)cc1 Amb35651544 [0,0,0,0,2,0|2,0,0]=4 1890 B14R2.101 c1ccc(OCc2ccsc2)cc1 Amb27263375 [0,0,0,0,2,0|1,0,0]=3 1891 B14R2.101 c1ccc(OCn2ccnc2)cc1 Amb27956452 [0,0,0,0,2,0|2,0,0]=4 1892 B14R2.101 c1ccc(SCc2cccs2)cc1 Amb26436043 [0,0,0,0,2,0|1,1,0]=4 1893 B14R2.101 c1cncc(OCc2cccs2)c1 Amb27850522 [0,0,0,0,2,0|2,0,0]=4 1894 B14R2.101 c1cncc(OCc2ccoc2)c1 Amb27479924 [0,0,0,0,2,0|2,0,0]=4 1895 B18R2.2525 C(#Cc1ccccc1)CNCc2cccnc2 Amb1090080 [0,0,0,0,0,2|2,0,0]=4 1896 B18R2.2525 C(/C\C=N\c1ccccc1)=N\c2ccccc2 Amb34916491 [0,0,0,0,0,2|2,0,0]=4 1897 B18R2.2525 C(=C\c1ccccc1)/CNCc2ccccc2 Amb1855576 [0,0,0,0,0,2|1,0,0]=3 1898 B18R2.2525 C(=C\c1ccccc1)/CNCc2ccccn2 Amb5253622 [0,0,0,0,0,2|2,0,0]=4 1899 B18R2.2525 C(=C\c1ccccc1)/CNCc2cccnc2 Amb6352159 [0,0,0,0,0,2|2,0,0]=4 1900 B18R2.2525 C(=C\c1ccccc1)/CNCc2ccncc2 Amb22528714 [0,0,0,0,0,2|2,0,0]=4 1901 B18R2.2525 C(=C\c1ccccc1)/COCc2ccccc2 Amb35781860 [0,0,0,0,0,2|0,0,0]=2 1902 B18R2.2525 c1ccc(CCCCNc2ccccc2)cc1 Amb28728654 [0,0,0,0,0,2|1,0,0]=3 1903 B18R2.2525 c1ccc(CCCNCc2cccnc2)cc1 Amb6729940 [0,0,0,0,0,2|2,0,0]=4 1904 B18R2.2525 c1ccc(CCNCCc2ccccc2)cc1 Amb1103723 [0,0,0,0,0,2|1,0,0]=3 1905 B18R2.2525 c1ccc(CCNCCc2ccccc2)cc1 Amb2119307 [0,0,0,0,0,2|1,0,0]=3 1906 B18R2.2525 c1ccc(CCNCCc2ccncc2)cc1 Amb33482931 [0,0,0,0,0,2|2,0,0]=4 1907 B18R2.2525 c1ccc(CCNOCc2ccccc2)cc1 Amb25231901 [0,0,0,0,0,2|0,0,0]=2 1908 B18R2.2525 c1ccc(CNCCCc2ccncc2)cc1 Amb2694637 [0,0,0,0,0,2|2,0,0]=4 1909 B18R2.2525 c1ccc(CNCCNc2ccccc2)cc1 Amb1086650 [0,0,0,0,0,2|1,0,0]=3 1910 B18R2.2525 c1ccc(CNCCNc2ccccc2)cc1 Amb24113424 [0,0,0,0,0,2|1,0,0]=3 1911 B18R2.2525 c1ccc(CNCCOc2ccccn2)cc1 Amb19920093 [0,0,0,0,0,2|2,0,0]=4 1912 B18R2.2525 c1ccc(CNCCOc2ccccn2)cc1 Amb29844627 [0,0,0,0,0,2|2,0,0]=4 1913 B18R2.2525 c1ccc(CNCCSc2ccccn2)cc1 Amb28145640 [0,0,0,0,0,2|2,0,0]=4 1914 B18R2.2525 c1ccc(CNCCSc2ccncc2)cc1 Amb28369015 [0,0,0,0,0,2|2,0,0]=4 1915 B18R2.2525 c1ccc(CNCNCc2ccccc2)cc1 Amb4004618 [0,0,0,0,0,2|1,0,0]=3 1916 B18R2.2525 c1ccc(CNNOCc2ccccc2)cc1 Amb28122329 [0,0,0,0,0,2|0,0,0]=2 1917 B18R2.2525 c1ccc(COCCNc2cccnn2)cc1 Amb27634385 [0,0,0,0,0,2|2,0,0]=4 1918 B18R2.2525 c1ccc(COCCOc2ccccc2)cc1 Amb27767737 [0,0,0,0,0,2|0,0,0]=2 1919 B18R2.2525 c1ccc(COCOCc2ccccc2)cc1 Amb8505030 [0,0,0,0,0,2|0,0,0]=2 1920 B18R2.2525 c1ccc(CONCCc2cccnc2)cc1 Amb27869722 [0,0,0,0,0,2|1,0,0]=3 1921 B18R2.2525 c1ccc(OCCCNc2ccccn2)cc1 Amb17100199 [0,0,0,0,0,2|2,0,0]=4 1922 B18R2.2525 c1ccc(SCCCSc2ccccc2)cc1 Amb6357086 [0,0,0,0,0,2|1,0,0]=3